USER MOD reduce.3.24.130724 H: found=0, std=0, add=923, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 921 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 109 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 111 THR OG1 : rot -17:sc= 0.787 USER MOD Set 2.1: A 78 ASN : amide:sc= -2.91 K(o=-3.3,f=-4.6!) USER MOD Set 2.2: A 80 GLN : amide:sc= -0.352 X(o=-3.3,f=-3.2) USER MOD Set 3.1: A 27 GLN : amide:sc= -0.886 K(o=-1.2,f=-2.4!) USER MOD Set 3.2: A 61 HIS : no HD1:sc= -0.356 X(o=-1.2,f=-1.4) USER MOD Single : A 1 GLY N :NH3+ 139:sc= 0.0467 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot -150:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0.00119 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 TYR OH : rot 180:sc= -0.0316 USER MOD Single : A 18 ASN : amide:sc= -0.617 X(o=-0.62,f=-0.31) USER MOD Single : A 24 LYS NZ :NH3+ -144:sc= -0.138 (180deg=-0.978) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot 180:sc= -0.106 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 41 HIS : no HD1:sc= -1.02 K(o=-1,f=-2.4!) USER MOD Single : A 42 THR OG1 : rot 180:sc=-0.00253 USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 49 TYR OH : rot 180:sc= -0.0594 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 SER OG : rot 38:sc= 0.927 USER MOD Single : A 57 SER OG : rot 111:sc= 0.7 USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 ASN : amide:sc= -2.76 K(o=-2.8,f=-1.9!) USER MOD Single : A 64 HIS : no HD1:sc= -0.413 X(o=-0.41,f=-0.084) USER MOD Single : A 66 GLN : amide:sc= -5.55! C(o=-5.6!,f=-5.2!) USER MOD Single : A 68 ASN : amide:sc=-0.00516 K(o=-0.0052,f=-0.54) USER MOD Single : A 70 LYS NZ :NH3+ -156:sc= -0.09 (180deg=-0.475) USER MOD Single : A 84 ASN : amide:sc= -5.09! C(o=-5.1!,f=-4.8!) USER MOD Single : A 85 HIS : no HD1:sc= -0.14 K(o=-0.14,f=-1.3) USER MOD Single : A 93 ASN : amide:sc= 1.05 K(o=1,f=-0.0097) USER MOD Single : A 96 GLN : amide:sc= 1.09 K(o=1.1,f=-0.008) USER MOD Single : A 99 HIS : no HD1:sc= -2.79! C(o=-2.8!,f=-3.1!) USER MOD Single : A 101 THR OG1 : rot 75:sc= -1.04! USER MOD Single : A 106 LYS NZ :NH3+ -159:sc= 0.22 (180deg=0.0907) USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot 47:sc= 0.601 USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 122 THR OG1 : rot 180:sc= 0 USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -20.666 7.890 -30.512 1.00 0.00 N ATOM 2 CA GLY A 1 -21.381 6.971 -29.645 1.00 0.00 C ATOM 3 C GLY A 1 -21.432 5.564 -30.208 1.00 0.00 C ATOM 4 O GLY A 1 -21.382 5.372 -31.423 1.00 0.00 O ATOM 0 H1 GLY A 1 -21.168 8.800 -30.543 1.00 0.00 H new ATOM 0 H2 GLY A 1 -19.704 8.037 -30.144 1.00 0.00 H new ATOM 0 H3 GLY A 1 -20.613 7.492 -31.471 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -20.900 6.951 -28.667 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -22.397 7.335 -29.493 1.00 0.00 H new ATOM 8 N SER A 2 -21.530 4.578 -29.323 1.00 0.00 N ATOM 9 CA SER A 2 -21.583 3.181 -29.738 1.00 0.00 C ATOM 10 C SER A 2 -22.941 2.567 -29.412 1.00 0.00 C ATOM 11 O SER A 2 -23.675 3.073 -28.562 1.00 0.00 O ATOM 12 CB SER A 2 -20.472 2.381 -29.054 1.00 0.00 C ATOM 13 OG SER A 2 -19.193 2.855 -29.438 1.00 0.00 O ATOM 0 H SER A 2 -21.574 4.720 -28.314 1.00 0.00 H new ATOM 0 HA SER A 2 -21.437 3.144 -30.818 1.00 0.00 H new ATOM 0 HB2 SER A 2 -20.581 2.454 -27.972 1.00 0.00 H new ATOM 0 HB3 SER A 2 -20.566 1.327 -29.314 1.00 0.00 H new ATOM 0 HG SER A 2 -18.500 2.329 -28.987 1.00 0.00 H new ATOM 19 N SER A 3 -23.269 1.475 -30.094 1.00 0.00 N ATOM 20 CA SER A 3 -24.541 0.794 -29.880 1.00 0.00 C ATOM 21 C SER A 3 -24.883 0.736 -28.395 1.00 0.00 C ATOM 22 O SER A 3 -24.019 0.919 -27.539 1.00 0.00 O ATOM 23 CB SER A 3 -24.489 -0.622 -30.459 1.00 0.00 C ATOM 24 OG SER A 3 -23.730 -1.484 -29.629 1.00 0.00 O ATOM 0 H SER A 3 -22.672 1.043 -30.799 1.00 0.00 H new ATOM 0 HA SER A 3 -25.319 1.360 -30.392 1.00 0.00 H new ATOM 0 HB2 SER A 3 -25.501 -1.012 -30.565 1.00 0.00 H new ATOM 0 HB3 SER A 3 -24.052 -0.595 -31.457 1.00 0.00 H new ATOM 0 HG SER A 3 -23.310 -2.180 -30.177 1.00 0.00 H new ATOM 30 N GLY A 4 -26.154 0.480 -28.096 1.00 0.00 N ATOM 31 CA GLY A 4 -26.590 0.402 -26.714 1.00 0.00 C ATOM 32 C GLY A 4 -27.067 -0.985 -26.334 1.00 0.00 C ATOM 33 O GLY A 4 -28.119 -1.434 -26.789 1.00 0.00 O ATOM 0 H GLY A 4 -26.889 0.325 -28.786 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -25.768 0.692 -26.060 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -27.396 1.118 -26.549 1.00 0.00 H new ATOM 37 N SER A 5 -26.291 -1.668 -25.498 1.00 0.00 N ATOM 38 CA SER A 5 -26.638 -3.015 -25.061 1.00 0.00 C ATOM 39 C SER A 5 -25.698 -3.486 -23.955 1.00 0.00 C ATOM 40 O SER A 5 -24.719 -2.814 -23.629 1.00 0.00 O ATOM 41 CB SER A 5 -26.582 -3.987 -26.241 1.00 0.00 C ATOM 42 OG SER A 5 -27.308 -5.172 -25.961 1.00 0.00 O ATOM 0 H SER A 5 -25.418 -1.310 -25.110 1.00 0.00 H new ATOM 0 HA SER A 5 -27.654 -2.992 -24.666 1.00 0.00 H new ATOM 0 HB2 SER A 5 -26.991 -3.508 -27.131 1.00 0.00 H new ATOM 0 HB3 SER A 5 -25.544 -4.236 -26.462 1.00 0.00 H new ATOM 0 HG SER A 5 -27.258 -5.776 -26.731 1.00 0.00 H new ATOM 48 N SER A 6 -26.004 -4.645 -23.381 1.00 0.00 N ATOM 49 CA SER A 6 -25.190 -5.206 -22.309 1.00 0.00 C ATOM 50 C SER A 6 -23.790 -5.545 -22.810 1.00 0.00 C ATOM 51 O SER A 6 -23.620 -6.388 -23.690 1.00 0.00 O ATOM 52 CB SER A 6 -25.856 -6.458 -21.736 1.00 0.00 C ATOM 53 OG SER A 6 -26.876 -6.116 -20.812 1.00 0.00 O ATOM 0 H SER A 6 -26.810 -5.214 -23.640 1.00 0.00 H new ATOM 0 HA SER A 6 -25.104 -4.457 -21.522 1.00 0.00 H new ATOM 0 HB2 SER A 6 -26.279 -7.052 -22.546 1.00 0.00 H new ATOM 0 HB3 SER A 6 -25.108 -7.079 -21.243 1.00 0.00 H new ATOM 0 HG SER A 6 -27.287 -6.933 -20.461 1.00 0.00 H new ATOM 59 N GLY A 7 -22.787 -4.881 -22.242 1.00 0.00 N ATOM 60 CA GLY A 7 -21.414 -5.124 -22.643 1.00 0.00 C ATOM 61 C GLY A 7 -20.500 -3.960 -22.317 1.00 0.00 C ATOM 62 O GLY A 7 -20.882 -2.801 -22.465 1.00 0.00 O ATOM 0 H GLY A 7 -22.902 -4.179 -21.511 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -21.047 -6.021 -22.145 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -21.381 -5.319 -23.715 1.00 0.00 H new ATOM 66 N GLY A 8 -19.286 -4.270 -21.870 1.00 0.00 N ATOM 67 CA GLY A 8 -18.334 -3.230 -21.527 1.00 0.00 C ATOM 68 C GLY A 8 -16.923 -3.763 -21.374 1.00 0.00 C ATOM 69 O GLY A 8 -16.673 -4.650 -20.558 1.00 0.00 O ATOM 0 H GLY A 8 -18.946 -5.223 -21.740 1.00 0.00 H new ATOM 0 HA2 GLY A 8 -18.347 -2.461 -22.299 1.00 0.00 H new ATOM 0 HA3 GLY A 8 -18.642 -2.753 -20.597 1.00 0.00 H new ATOM 73 N SER A 9 -15.999 -3.222 -22.160 1.00 0.00 N ATOM 74 CA SER A 9 -14.607 -3.652 -22.112 1.00 0.00 C ATOM 75 C SER A 9 -13.947 -3.212 -20.809 1.00 0.00 C ATOM 76 O SER A 9 -13.226 -2.215 -20.771 1.00 0.00 O ATOM 77 CB SER A 9 -13.834 -3.086 -23.305 1.00 0.00 C ATOM 78 OG SER A 9 -13.987 -3.909 -24.448 1.00 0.00 O ATOM 0 H SER A 9 -16.189 -2.484 -22.838 1.00 0.00 H new ATOM 0 HA SER A 9 -14.588 -4.741 -22.159 1.00 0.00 H new ATOM 0 HB2 SER A 9 -14.188 -2.080 -23.528 1.00 0.00 H new ATOM 0 HB3 SER A 9 -12.777 -3.003 -23.051 1.00 0.00 H new ATOM 0 HG SER A 9 -13.485 -3.525 -25.197 1.00 0.00 H new ATOM 84 N ASP A 10 -14.200 -3.963 -19.742 1.00 0.00 N ATOM 85 CA ASP A 10 -13.630 -3.652 -18.436 1.00 0.00 C ATOM 86 C ASP A 10 -12.499 -4.617 -18.093 1.00 0.00 C ATOM 87 O ASP A 10 -12.658 -5.501 -17.250 1.00 0.00 O ATOM 88 CB ASP A 10 -14.713 -3.711 -17.357 1.00 0.00 C ATOM 89 CG ASP A 10 -15.568 -4.958 -17.462 1.00 0.00 C ATOM 90 OD1 ASP A 10 -15.131 -6.019 -16.969 1.00 0.00 O ATOM 91 OD2 ASP A 10 -16.673 -4.874 -18.038 1.00 0.00 O ATOM 0 H ASP A 10 -14.796 -4.791 -19.756 1.00 0.00 H new ATOM 0 HA ASP A 10 -13.222 -2.642 -18.476 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -14.244 -3.677 -16.374 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -15.350 -2.830 -17.437 1.00 0.00 H new ATOM 96 N SER A 11 -11.358 -4.442 -18.751 1.00 0.00 N ATOM 97 CA SER A 11 -10.202 -5.300 -18.519 1.00 0.00 C ATOM 98 C SER A 11 -9.228 -4.647 -17.544 1.00 0.00 C ATOM 99 O SER A 11 -9.021 -5.137 -16.434 1.00 0.00 O ATOM 100 CB SER A 11 -9.493 -5.604 -19.840 1.00 0.00 C ATOM 101 OG SER A 11 -8.484 -6.584 -19.664 1.00 0.00 O ATOM 0 H SER A 11 -11.209 -3.714 -19.449 1.00 0.00 H new ATOM 0 HA SER A 11 -10.555 -6.234 -18.081 1.00 0.00 H new ATOM 0 HB2 SER A 11 -10.219 -5.953 -20.574 1.00 0.00 H new ATOM 0 HB3 SER A 11 -9.051 -4.690 -20.238 1.00 0.00 H new ATOM 0 HG SER A 11 -8.047 -6.762 -20.523 1.00 0.00 H new ATOM 107 N SER A 12 -8.632 -3.537 -17.967 1.00 0.00 N ATOM 108 CA SER A 12 -7.676 -2.817 -17.134 1.00 0.00 C ATOM 109 C SER A 12 -8.395 -1.891 -16.158 1.00 0.00 C ATOM 110 O SER A 12 -8.845 -0.806 -16.530 1.00 0.00 O ATOM 111 CB SER A 12 -6.713 -2.009 -18.006 1.00 0.00 C ATOM 112 OG SER A 12 -6.013 -2.850 -18.907 1.00 0.00 O ATOM 0 H SER A 12 -8.794 -3.117 -18.882 1.00 0.00 H new ATOM 0 HA SER A 12 -7.108 -3.550 -16.561 1.00 0.00 H new ATOM 0 HB2 SER A 12 -7.268 -1.255 -18.564 1.00 0.00 H new ATOM 0 HB3 SER A 12 -6.002 -1.478 -17.373 1.00 0.00 H new ATOM 0 HG SER A 12 -5.405 -2.310 -19.454 1.00 0.00 H new ATOM 118 N LEU A 13 -8.500 -2.326 -14.907 1.00 0.00 N ATOM 119 CA LEU A 13 -9.164 -1.537 -13.875 1.00 0.00 C ATOM 120 C LEU A 13 -8.174 -0.611 -13.176 1.00 0.00 C ATOM 121 O LEU A 13 -8.552 0.438 -12.653 1.00 0.00 O ATOM 122 CB LEU A 13 -9.830 -2.458 -12.851 1.00 0.00 C ATOM 123 CG LEU A 13 -11.125 -3.136 -13.301 1.00 0.00 C ATOM 124 CD1 LEU A 13 -10.886 -3.965 -14.553 1.00 0.00 C ATOM 125 CD2 LEU A 13 -11.688 -4.002 -12.184 1.00 0.00 C ATOM 0 H LEU A 13 -8.134 -3.221 -14.583 1.00 0.00 H new ATOM 0 HA LEU A 13 -9.928 -0.925 -14.355 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -9.116 -3.233 -12.570 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -10.040 -1.878 -11.953 1.00 0.00 H new ATOM 0 HG LEU A 13 -11.856 -2.362 -13.537 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -11.818 -4.440 -14.858 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -10.528 -3.319 -15.355 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -10.140 -4.732 -14.345 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -12.609 -4.477 -12.521 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -10.961 -4.769 -11.917 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -11.897 -3.381 -11.313 1.00 0.00 H new ATOM 137 N PHE A 14 -6.905 -1.006 -13.171 1.00 0.00 N ATOM 138 CA PHE A 14 -5.860 -0.211 -12.537 1.00 0.00 C ATOM 139 C PHE A 14 -4.994 0.484 -13.584 1.00 0.00 C ATOM 140 O PHE A 14 -4.951 0.070 -14.742 1.00 0.00 O ATOM 141 CB PHE A 14 -4.988 -1.095 -11.643 1.00 0.00 C ATOM 142 CG PHE A 14 -5.778 -2.013 -10.754 1.00 0.00 C ATOM 143 CD1 PHE A 14 -6.301 -3.197 -11.248 1.00 0.00 C ATOM 144 CD2 PHE A 14 -5.998 -1.691 -9.424 1.00 0.00 C ATOM 145 CE1 PHE A 14 -7.029 -4.043 -10.433 1.00 0.00 C ATOM 146 CE2 PHE A 14 -6.725 -2.533 -8.604 1.00 0.00 C ATOM 147 CZ PHE A 14 -7.240 -3.711 -9.109 1.00 0.00 C ATOM 0 H PHE A 14 -6.576 -1.871 -13.599 1.00 0.00 H new ATOM 0 HA PHE A 14 -6.341 0.552 -11.924 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -4.326 -1.691 -12.271 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -4.354 -0.459 -11.024 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -6.138 -3.462 -12.282 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -5.597 -0.772 -9.024 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -7.432 -4.962 -10.831 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -6.890 -2.270 -7.570 1.00 0.00 H new ATOM 0 HZ PHE A 14 -7.807 -4.371 -8.470 1.00 0.00 H new ATOM 157 N GLU A 15 -4.306 1.542 -13.166 1.00 0.00 N ATOM 158 CA GLU A 15 -3.442 2.295 -14.068 1.00 0.00 C ATOM 159 C GLU A 15 -2.007 2.325 -13.549 1.00 0.00 C ATOM 160 O GLU A 15 -1.761 2.658 -12.390 1.00 0.00 O ATOM 161 CB GLU A 15 -3.965 3.723 -14.237 1.00 0.00 C ATOM 162 CG GLU A 15 -4.408 4.367 -12.934 1.00 0.00 C ATOM 163 CD GLU A 15 -4.356 5.881 -12.985 1.00 0.00 C ATOM 164 OE1 GLU A 15 -5.063 6.471 -13.830 1.00 0.00 O ATOM 165 OE2 GLU A 15 -3.609 6.477 -12.181 1.00 0.00 O ATOM 0 H GLU A 15 -4.330 1.897 -12.210 1.00 0.00 H new ATOM 0 HA GLU A 15 -3.449 1.796 -15.037 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -3.185 4.336 -14.688 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -4.805 3.714 -14.932 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -5.425 4.050 -12.703 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -3.772 4.012 -12.123 1.00 0.00 H new ATOM 172 N THR A 16 -1.063 1.973 -14.416 1.00 0.00 N ATOM 173 CA THR A 16 0.347 1.958 -14.047 1.00 0.00 C ATOM 174 C THR A 16 1.035 3.257 -14.448 1.00 0.00 C ATOM 175 O THR A 16 0.756 3.816 -15.509 1.00 0.00 O ATOM 176 CB THR A 16 1.086 0.775 -14.700 1.00 0.00 C ATOM 177 OG1 THR A 16 0.378 -0.444 -14.450 1.00 0.00 O ATOM 178 CG2 THR A 16 2.506 0.662 -14.166 1.00 0.00 C ATOM 0 H THR A 16 -1.250 1.694 -15.379 1.00 0.00 H new ATOM 0 HA THR A 16 0.388 1.849 -12.963 1.00 0.00 H new ATOM 0 HB THR A 16 1.132 0.953 -15.774 1.00 0.00 H new ATOM 0 HG1 THR A 16 0.854 -1.191 -14.870 1.00 0.00 H new ATOM 0 HG21 THR A 16 3.008 -0.181 -14.642 1.00 0.00 H new ATOM 0 HG22 THR A 16 3.051 1.580 -14.385 1.00 0.00 H new ATOM 0 HG23 THR A 16 2.478 0.505 -13.088 1.00 0.00 H new ATOM 186 N TYR A 17 1.935 3.733 -13.595 1.00 0.00 N ATOM 187 CA TYR A 17 2.662 4.968 -13.861 1.00 0.00 C ATOM 188 C TYR A 17 4.042 4.939 -13.210 1.00 0.00 C ATOM 189 O TYR A 17 4.238 4.304 -12.175 1.00 0.00 O ATOM 190 CB TYR A 17 1.869 6.172 -13.348 1.00 0.00 C ATOM 191 CG TYR A 17 1.583 6.121 -11.864 1.00 0.00 C ATOM 192 CD1 TYR A 17 0.589 5.293 -11.357 1.00 0.00 C ATOM 193 CD2 TYR A 17 2.306 6.901 -10.970 1.00 0.00 C ATOM 194 CE1 TYR A 17 0.323 5.244 -10.002 1.00 0.00 C ATOM 195 CE2 TYR A 17 2.049 6.856 -9.614 1.00 0.00 C ATOM 196 CZ TYR A 17 1.056 6.027 -9.135 1.00 0.00 C ATOM 197 OH TYR A 17 0.796 5.981 -7.784 1.00 0.00 O ATOM 0 H TYR A 17 2.179 3.282 -12.713 1.00 0.00 H new ATOM 0 HA TYR A 17 2.791 5.059 -14.940 1.00 0.00 H new ATOM 0 HB2 TYR A 17 2.423 7.083 -13.572 1.00 0.00 H new ATOM 0 HB3 TYR A 17 0.925 6.232 -13.890 1.00 0.00 H new ATOM 0 HD1 TYR A 17 0.015 4.677 -12.033 1.00 0.00 H new ATOM 0 HD2 TYR A 17 3.082 7.554 -11.342 1.00 0.00 H new ATOM 0 HE1 TYR A 17 -0.454 4.596 -9.624 1.00 0.00 H new ATOM 0 HE2 TYR A 17 2.622 7.467 -8.932 1.00 0.00 H new ATOM 0 HH TYR A 17 1.401 6.592 -7.313 1.00 0.00 H new ATOM 207 N ASN A 18 4.994 5.633 -13.826 1.00 0.00 N ATOM 208 CA ASN A 18 6.356 5.688 -13.307 1.00 0.00 C ATOM 209 C ASN A 18 6.641 7.044 -12.670 1.00 0.00 C ATOM 210 O ASN A 18 6.295 8.088 -13.224 1.00 0.00 O ATOM 211 CB ASN A 18 7.362 5.416 -14.428 1.00 0.00 C ATOM 212 CG ASN A 18 6.865 5.894 -15.779 1.00 0.00 C ATOM 213 OD1 ASN A 18 7.232 6.974 -16.242 1.00 0.00 O ATOM 214 ND2 ASN A 18 6.024 5.089 -16.418 1.00 0.00 N ATOM 0 H ASN A 18 4.848 6.164 -14.684 1.00 0.00 H new ATOM 0 HA ASN A 18 6.458 4.919 -12.541 1.00 0.00 H new ATOM 0 HB2 ASN A 18 8.305 5.911 -14.195 1.00 0.00 H new ATOM 0 HB3 ASN A 18 7.567 4.347 -14.477 1.00 0.00 H new ATOM 0 HD21 ASN A 18 5.655 5.357 -17.330 1.00 0.00 H new ATOM 0 HD22 ASN A 18 5.747 4.203 -15.996 1.00 0.00 H new ATOM 221 N VAL A 19 7.275 7.021 -11.502 1.00 0.00 N ATOM 222 CA VAL A 19 7.609 8.249 -10.789 1.00 0.00 C ATOM 223 C VAL A 19 9.118 8.395 -10.624 1.00 0.00 C ATOM 224 O VAL A 19 9.754 7.611 -9.921 1.00 0.00 O ATOM 225 CB VAL A 19 6.945 8.289 -9.400 1.00 0.00 C ATOM 226 CG1 VAL A 19 6.748 9.727 -8.944 1.00 0.00 C ATOM 227 CG2 VAL A 19 5.621 7.541 -9.421 1.00 0.00 C ATOM 0 H VAL A 19 7.568 6.166 -11.029 1.00 0.00 H new ATOM 0 HA VAL A 19 7.230 9.077 -11.388 1.00 0.00 H new ATOM 0 HB VAL A 19 7.604 7.794 -8.687 1.00 0.00 H new ATOM 0 HG11 VAL A 19 6.278 9.736 -7.961 1.00 0.00 H new ATOM 0 HG12 VAL A 19 7.715 10.227 -8.888 1.00 0.00 H new ATOM 0 HG13 VAL A 19 6.110 10.250 -9.656 1.00 0.00 H new ATOM 0 HG21 VAL A 19 5.166 7.579 -8.431 1.00 0.00 H new ATOM 0 HG22 VAL A 19 4.953 8.005 -10.146 1.00 0.00 H new ATOM 0 HG23 VAL A 19 5.795 6.502 -9.700 1.00 0.00 H new ATOM 237 N GLU A 20 9.684 9.406 -11.277 1.00 0.00 N ATOM 238 CA GLU A 20 11.119 9.655 -11.202 1.00 0.00 C ATOM 239 C GLU A 20 11.463 10.484 -9.968 1.00 0.00 C ATOM 240 O GLU A 20 11.454 11.715 -10.011 1.00 0.00 O ATOM 241 CB GLU A 20 11.600 10.373 -12.464 1.00 0.00 C ATOM 242 CG GLU A 20 13.072 10.750 -12.425 1.00 0.00 C ATOM 243 CD GLU A 20 13.385 11.967 -13.274 1.00 0.00 C ATOM 244 OE1 GLU A 20 12.472 12.794 -13.484 1.00 0.00 O ATOM 245 OE2 GLU A 20 14.541 12.093 -13.728 1.00 0.00 O ATOM 0 H GLU A 20 9.171 10.065 -11.863 1.00 0.00 H new ATOM 0 HA GLU A 20 11.626 8.693 -11.125 1.00 0.00 H new ATOM 0 HB2 GLU A 20 11.420 9.732 -13.327 1.00 0.00 H new ATOM 0 HB3 GLU A 20 11.006 11.276 -12.607 1.00 0.00 H new ATOM 0 HG2 GLU A 20 13.366 10.946 -11.394 1.00 0.00 H new ATOM 0 HG3 GLU A 20 13.669 9.906 -12.772 1.00 0.00 H new ATOM 252 N LEU A 21 11.766 9.801 -8.869 1.00 0.00 N ATOM 253 CA LEU A 21 12.114 10.473 -7.622 1.00 0.00 C ATOM 254 C LEU A 21 13.561 10.954 -7.648 1.00 0.00 C ATOM 255 O LEU A 21 14.450 10.256 -8.137 1.00 0.00 O ATOM 256 CB LEU A 21 11.898 9.533 -6.436 1.00 0.00 C ATOM 257 CG LEU A 21 10.444 9.192 -6.105 1.00 0.00 C ATOM 258 CD1 LEU A 21 10.377 8.177 -4.974 1.00 0.00 C ATOM 259 CD2 LEU A 21 9.671 10.451 -5.741 1.00 0.00 C ATOM 0 H LEU A 21 11.778 8.782 -8.816 1.00 0.00 H new ATOM 0 HA LEU A 21 11.464 11.341 -7.512 1.00 0.00 H new ATOM 0 HB2 LEU A 21 12.432 8.604 -6.633 1.00 0.00 H new ATOM 0 HB3 LEU A 21 12.355 9.982 -5.554 1.00 0.00 H new ATOM 0 HG LEU A 21 9.984 8.750 -6.989 1.00 0.00 H new ATOM 0 HD11 LEU A 21 9.335 7.947 -4.753 1.00 0.00 H new ATOM 0 HD12 LEU A 21 10.894 7.265 -5.272 1.00 0.00 H new ATOM 0 HD13 LEU A 21 10.854 8.591 -4.085 1.00 0.00 H new ATOM 0 HD21 LEU A 21 8.639 10.190 -5.509 1.00 0.00 H new ATOM 0 HD22 LEU A 21 10.131 10.922 -4.872 1.00 0.00 H new ATOM 0 HD23 LEU A 21 9.689 11.145 -6.581 1.00 0.00 H new ATOM 271 N VAL A 22 13.791 12.150 -7.116 1.00 0.00 N ATOM 272 CA VAL A 22 15.131 12.723 -7.074 1.00 0.00 C ATOM 273 C VAL A 22 15.713 12.660 -5.667 1.00 0.00 C ATOM 274 O VAL A 22 14.999 12.843 -4.680 1.00 0.00 O ATOM 275 CB VAL A 22 15.131 14.188 -7.552 1.00 0.00 C ATOM 276 CG1 VAL A 22 14.257 15.044 -6.648 1.00 0.00 C ATOM 277 CG2 VAL A 22 16.550 14.731 -7.605 1.00 0.00 C ATOM 0 H VAL A 22 13.067 12.741 -6.708 1.00 0.00 H new ATOM 0 HA VAL A 22 15.749 12.129 -7.747 1.00 0.00 H new ATOM 0 HB VAL A 22 14.715 14.224 -8.559 1.00 0.00 H new ATOM 0 HG11 VAL A 22 14.269 16.075 -7.001 1.00 0.00 H new ATOM 0 HG12 VAL A 22 13.235 14.666 -6.666 1.00 0.00 H new ATOM 0 HG13 VAL A 22 14.640 15.005 -5.628 1.00 0.00 H new ATOM 0 HG21 VAL A 22 16.531 15.767 -7.945 1.00 0.00 H new ATOM 0 HG22 VAL A 22 16.995 14.683 -6.611 1.00 0.00 H new ATOM 0 HG23 VAL A 22 17.143 14.133 -8.297 1.00 0.00 H new ATOM 287 N ARG A 23 17.013 12.399 -5.581 1.00 0.00 N ATOM 288 CA ARG A 23 17.691 12.310 -4.293 1.00 0.00 C ATOM 289 C ARG A 23 18.583 13.527 -4.063 1.00 0.00 C ATOM 290 O ARG A 23 19.645 13.656 -4.672 1.00 0.00 O ATOM 291 CB ARG A 23 18.527 11.031 -4.220 1.00 0.00 C ATOM 292 CG ARG A 23 17.708 9.759 -4.368 1.00 0.00 C ATOM 293 CD ARG A 23 18.337 8.600 -3.611 1.00 0.00 C ATOM 294 NE ARG A 23 19.689 8.308 -4.081 1.00 0.00 N ATOM 295 CZ ARG A 23 20.590 7.648 -3.362 1.00 0.00 C ATOM 296 NH1 ARG A 23 20.285 7.213 -2.148 1.00 0.00 N ATOM 297 NH2 ARG A 23 21.800 7.421 -3.859 1.00 0.00 N ATOM 0 H ARG A 23 17.618 12.245 -6.388 1.00 0.00 H new ATOM 0 HA ARG A 23 16.931 12.285 -3.512 1.00 0.00 H new ATOM 0 HB2 ARG A 23 19.286 11.058 -5.002 1.00 0.00 H new ATOM 0 HB3 ARG A 23 19.054 11.005 -3.266 1.00 0.00 H new ATOM 0 HG2 ARG A 23 16.697 9.931 -3.998 1.00 0.00 H new ATOM 0 HG3 ARG A 23 17.622 9.501 -5.424 1.00 0.00 H new ATOM 0 HD2 ARG A 23 18.366 8.835 -2.547 1.00 0.00 H new ATOM 0 HD3 ARG A 23 17.714 7.713 -3.724 1.00 0.00 H new ATOM 0 HE ARG A 23 19.956 8.628 -5.012 1.00 0.00 H new ATOM 0 HH11 ARG A 23 19.356 7.385 -1.763 1.00 0.00 H new ATOM 0 HH12 ARG A 23 20.979 6.706 -1.598 1.00 0.00 H new ATOM 0 HH21 ARG A 23 22.038 7.753 -4.793 1.00 0.00 H new ATOM 0 HH22 ARG A 23 22.491 6.914 -3.306 1.00 0.00 H new ATOM 311 N LYS A 24 18.143 14.418 -3.181 1.00 0.00 N ATOM 312 CA LYS A 24 18.900 15.624 -2.869 1.00 0.00 C ATOM 313 C LYS A 24 20.358 15.290 -2.572 1.00 0.00 C ATOM 314 O LYS A 24 20.752 14.124 -2.581 1.00 0.00 O ATOM 315 CB LYS A 24 18.277 16.347 -1.672 1.00 0.00 C ATOM 316 CG LYS A 24 17.174 17.318 -2.055 1.00 0.00 C ATOM 317 CD LYS A 24 16.975 18.384 -0.990 1.00 0.00 C ATOM 318 CE LYS A 24 17.871 19.589 -1.234 1.00 0.00 C ATOM 319 NZ LYS A 24 19.208 19.423 -0.600 1.00 0.00 N ATOM 0 H LYS A 24 17.265 14.327 -2.669 1.00 0.00 H new ATOM 0 HA LYS A 24 18.866 16.279 -3.739 1.00 0.00 H new ATOM 0 HB2 LYS A 24 17.874 15.607 -0.981 1.00 0.00 H new ATOM 0 HB3 LYS A 24 19.058 16.889 -1.139 1.00 0.00 H new ATOM 0 HG2 LYS A 24 17.420 17.793 -3.005 1.00 0.00 H new ATOM 0 HG3 LYS A 24 16.242 16.772 -2.203 1.00 0.00 H new ATOM 0 HD2 LYS A 24 15.932 18.701 -0.981 1.00 0.00 H new ATOM 0 HD3 LYS A 24 17.189 17.963 -0.008 1.00 0.00 H new ATOM 0 HE2 LYS A 24 17.994 19.739 -2.307 1.00 0.00 H new ATOM 0 HE3 LYS A 24 17.391 20.485 -0.840 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 19.539 20.342 -0.242 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 19.137 18.749 0.189 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 19.883 19.062 -1.304 1.00 0.00 H new ATOM 333 N ASP A 25 21.155 16.320 -2.309 1.00 0.00 N ATOM 334 CA ASP A 25 22.569 16.135 -2.006 1.00 0.00 C ATOM 335 C ASP A 25 22.750 15.368 -0.700 1.00 0.00 C ATOM 336 O ASP A 25 22.817 15.962 0.376 1.00 0.00 O ATOM 337 CB ASP A 25 23.275 17.489 -1.919 1.00 0.00 C ATOM 338 CG ASP A 25 23.440 18.145 -3.276 1.00 0.00 C ATOM 339 OD1 ASP A 25 24.314 17.699 -4.049 1.00 0.00 O ATOM 340 OD2 ASP A 25 22.693 19.103 -3.566 1.00 0.00 O ATOM 0 H ASP A 25 20.846 17.292 -2.300 1.00 0.00 H new ATOM 0 HA ASP A 25 23.015 15.553 -2.812 1.00 0.00 H new ATOM 0 HB2 ASP A 25 22.706 18.151 -1.266 1.00 0.00 H new ATOM 0 HB3 ASP A 25 24.255 17.355 -1.462 1.00 0.00 H new ATOM 345 N GLY A 26 22.827 14.045 -0.802 1.00 0.00 N ATOM 346 CA GLY A 26 22.997 13.219 0.379 1.00 0.00 C ATOM 347 C GLY A 26 21.681 12.899 1.058 1.00 0.00 C ATOM 348 O GLY A 26 21.563 13.005 2.279 1.00 0.00 O ATOM 0 H GLY A 26 22.775 13.530 -1.681 1.00 0.00 H new ATOM 0 HA2 GLY A 26 23.493 12.290 0.100 1.00 0.00 H new ATOM 0 HA3 GLY A 26 23.651 13.730 1.085 1.00 0.00 H new ATOM 352 N GLN A 27 20.687 12.508 0.266 1.00 0.00 N ATOM 353 CA GLN A 27 19.372 12.175 0.799 1.00 0.00 C ATOM 354 C GLN A 27 18.967 10.758 0.404 1.00 0.00 C ATOM 355 O GLN A 27 19.391 10.248 -0.633 1.00 0.00 O ATOM 356 CB GLN A 27 18.328 13.174 0.300 1.00 0.00 C ATOM 357 CG GLN A 27 16.939 12.941 0.872 1.00 0.00 C ATOM 358 CD GLN A 27 15.857 13.657 0.089 1.00 0.00 C ATOM 359 OE1 GLN A 27 15.658 13.397 -1.098 1.00 0.00 O ATOM 360 NE2 GLN A 27 15.150 14.566 0.751 1.00 0.00 N ATOM 0 H GLN A 27 20.768 12.414 -0.746 1.00 0.00 H new ATOM 0 HA GLN A 27 19.425 12.228 1.886 1.00 0.00 H new ATOM 0 HB2 GLN A 27 18.652 14.183 0.555 1.00 0.00 H new ATOM 0 HB3 GLN A 27 18.277 13.121 -0.788 1.00 0.00 H new ATOM 0 HG2 GLN A 27 16.729 11.872 0.880 1.00 0.00 H new ATOM 0 HG3 GLN A 27 16.916 13.278 1.908 1.00 0.00 H new ATOM 0 HE21 GLN A 27 15.349 14.750 1.734 1.00 0.00 H new ATOM 0 HE22 GLN A 27 14.408 15.080 0.276 1.00 0.00 H new ATOM 369 N SER A 28 18.145 10.128 1.237 1.00 0.00 N ATOM 370 CA SER A 28 17.686 8.769 0.976 1.00 0.00 C ATOM 371 C SER A 28 16.285 8.775 0.372 1.00 0.00 C ATOM 372 O SER A 28 15.536 9.742 0.521 1.00 0.00 O ATOM 373 CB SER A 28 17.693 7.949 2.267 1.00 0.00 C ATOM 374 OG SER A 28 19.012 7.781 2.757 1.00 0.00 O ATOM 0 H SER A 28 17.783 10.537 2.098 1.00 0.00 H new ATOM 0 HA SER A 28 18.370 8.313 0.260 1.00 0.00 H new ATOM 0 HB2 SER A 28 17.082 8.446 3.021 1.00 0.00 H new ATOM 0 HB3 SER A 28 17.242 6.973 2.084 1.00 0.00 H new ATOM 0 HG SER A 28 18.989 7.255 3.584 1.00 0.00 H new ATOM 380 N LEU A 29 15.938 7.690 -0.312 1.00 0.00 N ATOM 381 CA LEU A 29 14.626 7.568 -0.939 1.00 0.00 C ATOM 382 C LEU A 29 13.515 7.888 0.055 1.00 0.00 C ATOM 383 O LEU A 29 12.823 8.897 -0.074 1.00 0.00 O ATOM 384 CB LEU A 29 14.436 6.158 -1.499 1.00 0.00 C ATOM 385 CG LEU A 29 13.494 6.032 -2.697 1.00 0.00 C ATOM 386 CD1 LEU A 29 13.960 6.922 -3.838 1.00 0.00 C ATOM 387 CD2 LEU A 29 13.399 4.583 -3.151 1.00 0.00 C ATOM 0 H LEU A 29 16.546 6.882 -0.447 1.00 0.00 H new ATOM 0 HA LEU A 29 14.573 8.287 -1.757 1.00 0.00 H new ATOM 0 HB2 LEU A 29 15.412 5.769 -1.788 1.00 0.00 H new ATOM 0 HB3 LEU A 29 14.062 5.519 -0.699 1.00 0.00 H new ATOM 0 HG LEU A 29 12.501 6.361 -2.390 1.00 0.00 H new ATOM 0 HD11 LEU A 29 13.278 6.819 -4.682 1.00 0.00 H new ATOM 0 HD12 LEU A 29 13.974 7.960 -3.507 1.00 0.00 H new ATOM 0 HD13 LEU A 29 14.963 6.625 -4.144 1.00 0.00 H new ATOM 0 HD21 LEU A 29 12.724 4.513 -4.004 1.00 0.00 H new ATOM 0 HD22 LEU A 29 14.388 4.227 -3.440 1.00 0.00 H new ATOM 0 HD23 LEU A 29 13.017 3.970 -2.335 1.00 0.00 H new ATOM 399 N GLY A 30 13.350 7.020 1.049 1.00 0.00 N ATOM 400 CA GLY A 30 12.323 7.228 2.053 1.00 0.00 C ATOM 401 C GLY A 30 11.014 6.553 1.692 1.00 0.00 C ATOM 402 O GLY A 30 9.952 7.174 1.747 1.00 0.00 O ATOM 0 H GLY A 30 13.909 6.177 1.177 1.00 0.00 H new ATOM 0 HA2 GLY A 30 12.673 6.845 3.012 1.00 0.00 H new ATOM 0 HA3 GLY A 30 12.154 8.297 2.179 1.00 0.00 H new ATOM 406 N ILE A 31 11.090 5.280 1.320 1.00 0.00 N ATOM 407 CA ILE A 31 9.903 4.521 0.948 1.00 0.00 C ATOM 408 C ILE A 31 9.913 3.136 1.587 1.00 0.00 C ATOM 409 O ILE A 31 10.765 2.304 1.276 1.00 0.00 O ATOM 410 CB ILE A 31 9.788 4.368 -0.580 1.00 0.00 C ATOM 411 CG1 ILE A 31 9.816 5.741 -1.255 1.00 0.00 C ATOM 412 CG2 ILE A 31 8.515 3.618 -0.944 1.00 0.00 C ATOM 413 CD1 ILE A 31 9.890 5.671 -2.764 1.00 0.00 C ATOM 0 H ILE A 31 11.961 4.752 1.268 1.00 0.00 H new ATOM 0 HA ILE A 31 9.043 5.082 1.314 1.00 0.00 H new ATOM 0 HB ILE A 31 10.640 3.790 -0.938 1.00 0.00 H new ATOM 0 HG12 ILE A 31 8.923 6.296 -0.969 1.00 0.00 H new ATOM 0 HG13 ILE A 31 10.673 6.302 -0.883 1.00 0.00 H new ATOM 0 HG21 ILE A 31 8.449 3.518 -2.027 1.00 0.00 H new ATOM 0 HG22 ILE A 31 8.533 2.628 -0.489 1.00 0.00 H new ATOM 0 HG23 ILE A 31 7.650 4.170 -0.577 1.00 0.00 H new ATOM 0 HD11 ILE A 31 9.906 6.681 -3.175 1.00 0.00 H new ATOM 0 HD12 ILE A 31 10.797 5.144 -3.060 1.00 0.00 H new ATOM 0 HD13 ILE A 31 9.020 5.138 -3.147 1.00 0.00 H new ATOM 425 N ARG A 32 8.959 2.895 2.480 1.00 0.00 N ATOM 426 CA ARG A 32 8.857 1.611 3.162 1.00 0.00 C ATOM 427 C ARG A 32 7.963 0.651 2.383 1.00 0.00 C ATOM 428 O ARG A 32 6.892 1.031 1.910 1.00 0.00 O ATOM 429 CB ARG A 32 8.307 1.803 4.577 1.00 0.00 C ATOM 430 CG ARG A 32 9.177 2.689 5.454 1.00 0.00 C ATOM 431 CD ARG A 32 10.326 1.906 6.070 1.00 0.00 C ATOM 432 NE ARG A 32 11.399 2.782 6.532 1.00 0.00 N ATOM 433 CZ ARG A 32 12.640 2.366 6.763 1.00 0.00 C ATOM 434 NH1 ARG A 32 12.961 1.093 6.575 1.00 0.00 N ATOM 435 NH2 ARG A 32 13.561 3.224 7.182 1.00 0.00 N ATOM 0 H ARG A 32 8.245 3.573 2.748 1.00 0.00 H new ATOM 0 HA ARG A 32 9.856 1.180 3.223 1.00 0.00 H new ATOM 0 HB2 ARG A 32 7.309 2.237 4.514 1.00 0.00 H new ATOM 0 HB3 ARG A 32 8.201 0.828 5.052 1.00 0.00 H new ATOM 0 HG2 ARG A 32 9.573 3.513 4.861 1.00 0.00 H new ATOM 0 HG3 ARG A 32 8.570 3.129 6.245 1.00 0.00 H new ATOM 0 HD2 ARG A 32 9.954 1.315 6.907 1.00 0.00 H new ATOM 0 HD3 ARG A 32 10.722 1.204 5.336 1.00 0.00 H new ATOM 0 HE ARG A 32 11.184 3.767 6.686 1.00 0.00 H new ATOM 0 HH11 ARG A 32 12.255 0.431 6.253 1.00 0.00 H new ATOM 0 HH12 ARG A 32 13.914 0.776 6.753 1.00 0.00 H new ATOM 0 HH21 ARG A 32 13.317 4.204 7.327 1.00 0.00 H new ATOM 0 HH22 ARG A 32 14.513 2.904 7.359 1.00 0.00 H new ATOM 449 N ILE A 33 8.411 -0.594 2.254 1.00 0.00 N ATOM 450 CA ILE A 33 7.651 -1.607 1.534 1.00 0.00 C ATOM 451 C ILE A 33 7.134 -2.684 2.481 1.00 0.00 C ATOM 452 O ILE A 33 7.603 -2.808 3.613 1.00 0.00 O ATOM 453 CB ILE A 33 8.500 -2.272 0.434 1.00 0.00 C ATOM 454 CG1 ILE A 33 9.748 -2.915 1.043 1.00 0.00 C ATOM 455 CG2 ILE A 33 8.887 -1.251 -0.626 1.00 0.00 C ATOM 456 CD1 ILE A 33 10.368 -3.979 0.165 1.00 0.00 C ATOM 0 H ILE A 33 9.296 -0.924 2.639 1.00 0.00 H new ATOM 0 HA ILE A 33 6.806 -1.097 1.072 1.00 0.00 H new ATOM 0 HB ILE A 33 7.906 -3.053 -0.041 1.00 0.00 H new ATOM 0 HG12 ILE A 33 10.488 -2.139 1.238 1.00 0.00 H new ATOM 0 HG13 ILE A 33 9.487 -3.356 2.005 1.00 0.00 H new ATOM 0 HG21 ILE A 33 9.487 -1.736 -1.396 1.00 0.00 H new ATOM 0 HG22 ILE A 33 7.986 -0.834 -1.076 1.00 0.00 H new ATOM 0 HG23 ILE A 33 9.466 -0.450 -0.166 1.00 0.00 H new ATOM 0 HD11 ILE A 33 11.248 -4.391 0.659 1.00 0.00 H new ATOM 0 HD12 ILE A 33 9.643 -4.774 -0.009 1.00 0.00 H new ATOM 0 HD13 ILE A 33 10.660 -3.539 -0.788 1.00 0.00 H new ATOM 468 N VAL A 34 6.165 -3.463 2.011 1.00 0.00 N ATOM 469 CA VAL A 34 5.585 -4.532 2.816 1.00 0.00 C ATOM 470 C VAL A 34 5.155 -5.706 1.942 1.00 0.00 C ATOM 471 O VAL A 34 4.635 -5.517 0.843 1.00 0.00 O ATOM 472 CB VAL A 34 4.370 -4.034 3.621 1.00 0.00 C ATOM 473 CG1 VAL A 34 3.114 -4.059 2.763 1.00 0.00 C ATOM 474 CG2 VAL A 34 4.185 -4.871 4.877 1.00 0.00 C ATOM 0 H VAL A 34 5.765 -3.374 1.077 1.00 0.00 H new ATOM 0 HA VAL A 34 6.359 -4.862 3.509 1.00 0.00 H new ATOM 0 HB VAL A 34 4.554 -3.003 3.923 1.00 0.00 H new ATOM 0 HG11 VAL A 34 2.266 -3.704 3.349 1.00 0.00 H new ATOM 0 HG12 VAL A 34 3.253 -3.413 1.896 1.00 0.00 H new ATOM 0 HG13 VAL A 34 2.922 -5.078 2.428 1.00 0.00 H new ATOM 0 HG21 VAL A 34 3.322 -4.506 5.434 1.00 0.00 H new ATOM 0 HG22 VAL A 34 4.023 -5.913 4.600 1.00 0.00 H new ATOM 0 HG23 VAL A 34 5.077 -4.796 5.499 1.00 0.00 H new ATOM 484 N GLY A 35 5.376 -6.919 2.440 1.00 0.00 N ATOM 485 CA GLY A 35 5.005 -8.106 1.692 1.00 0.00 C ATOM 486 C GLY A 35 3.607 -8.587 2.024 1.00 0.00 C ATOM 487 O GLY A 35 3.385 -9.199 3.070 1.00 0.00 O ATOM 0 H GLY A 35 5.805 -7.101 3.347 1.00 0.00 H new ATOM 0 HA2 GLY A 35 5.069 -7.894 0.625 1.00 0.00 H new ATOM 0 HA3 GLY A 35 5.719 -8.902 1.902 1.00 0.00 H new ATOM 491 N TYR A 36 2.661 -8.310 1.134 1.00 0.00 N ATOM 492 CA TYR A 36 1.275 -8.715 1.340 1.00 0.00 C ATOM 493 C TYR A 36 1.079 -10.186 0.983 1.00 0.00 C ATOM 494 O TYR A 36 1.827 -10.748 0.184 1.00 0.00 O ATOM 495 CB TYR A 36 0.337 -7.846 0.501 1.00 0.00 C ATOM 496 CG TYR A 36 -0.219 -6.657 1.251 1.00 0.00 C ATOM 497 CD1 TYR A 36 0.506 -5.476 1.356 1.00 0.00 C ATOM 498 CD2 TYR A 36 -1.468 -6.714 1.856 1.00 0.00 C ATOM 499 CE1 TYR A 36 0.003 -4.387 2.041 1.00 0.00 C ATOM 500 CE2 TYR A 36 -1.980 -5.629 2.542 1.00 0.00 C ATOM 501 CZ TYR A 36 -1.241 -4.468 2.631 1.00 0.00 C ATOM 502 OH TYR A 36 -1.747 -3.386 3.315 1.00 0.00 O ATOM 0 H TYR A 36 2.828 -7.807 0.263 1.00 0.00 H new ATOM 0 HA TYR A 36 1.037 -8.580 2.395 1.00 0.00 H new ATOM 0 HB2 TYR A 36 0.874 -7.491 -0.379 1.00 0.00 H new ATOM 0 HB3 TYR A 36 -0.490 -8.459 0.144 1.00 0.00 H new ATOM 0 HD1 TYR A 36 1.480 -5.408 0.894 1.00 0.00 H new ATOM 0 HD2 TYR A 36 -2.049 -7.622 1.789 1.00 0.00 H new ATOM 0 HE1 TYR A 36 0.581 -3.477 2.114 1.00 0.00 H new ATOM 0 HE2 TYR A 36 -2.953 -5.690 3.006 1.00 0.00 H new ATOM 0 HH TYR A 36 -2.634 -3.608 3.669 1.00 0.00 H new ATOM 512 N VAL A 37 0.065 -10.803 1.582 1.00 0.00 N ATOM 513 CA VAL A 37 -0.232 -12.207 1.328 1.00 0.00 C ATOM 514 C VAL A 37 -1.678 -12.390 0.881 1.00 0.00 C ATOM 515 O VAL A 37 -2.019 -13.381 0.236 1.00 0.00 O ATOM 516 CB VAL A 37 0.020 -13.070 2.579 1.00 0.00 C ATOM 517 CG1 VAL A 37 -0.298 -14.530 2.293 1.00 0.00 C ATOM 518 CG2 VAL A 37 1.456 -12.912 3.054 1.00 0.00 C ATOM 0 H VAL A 37 -0.564 -10.352 2.246 1.00 0.00 H new ATOM 0 HA VAL A 37 0.436 -12.533 0.531 1.00 0.00 H new ATOM 0 HB VAL A 37 -0.642 -12.728 3.375 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -0.114 -15.124 3.188 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -1.345 -14.624 2.003 1.00 0.00 H new ATOM 0 HG13 VAL A 37 0.337 -14.889 1.483 1.00 0.00 H new ATOM 0 HG21 VAL A 37 1.617 -13.528 3.938 1.00 0.00 H new ATOM 0 HG22 VAL A 37 2.137 -13.227 2.264 1.00 0.00 H new ATOM 0 HG23 VAL A 37 1.645 -11.867 3.301 1.00 0.00 H new ATOM 528 N GLY A 38 -2.526 -11.427 1.228 1.00 0.00 N ATOM 529 CA GLY A 38 -3.926 -11.500 0.854 1.00 0.00 C ATOM 530 C GLY A 38 -4.654 -12.633 1.550 1.00 0.00 C ATOM 531 O GLY A 38 -4.056 -13.660 1.874 1.00 0.00 O ATOM 0 H GLY A 38 -2.268 -10.597 1.762 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -4.413 -10.556 1.097 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -4.004 -11.631 -0.225 1.00 0.00 H new ATOM 535 N THR A 39 -5.950 -12.448 1.783 1.00 0.00 N ATOM 536 CA THR A 39 -6.759 -13.461 2.448 1.00 0.00 C ATOM 537 C THR A 39 -8.245 -13.141 2.330 1.00 0.00 C ATOM 538 O THR A 39 -8.625 -12.006 2.044 1.00 0.00 O ATOM 539 CB THR A 39 -6.390 -13.587 3.938 1.00 0.00 C ATOM 540 OG1 THR A 39 -7.124 -14.660 4.536 1.00 0.00 O ATOM 541 CG2 THR A 39 -6.682 -12.291 4.680 1.00 0.00 C ATOM 0 H THR A 39 -6.461 -11.605 1.521 1.00 0.00 H new ATOM 0 HA THR A 39 -6.552 -14.408 1.949 1.00 0.00 H new ATOM 0 HB THR A 39 -5.322 -13.795 4.008 1.00 0.00 H new ATOM 0 HG1 THR A 39 -6.882 -14.734 5.483 1.00 0.00 H new ATOM 0 HG21 THR A 39 -6.413 -12.405 5.730 1.00 0.00 H new ATOM 0 HG22 THR A 39 -6.099 -11.481 4.242 1.00 0.00 H new ATOM 0 HG23 THR A 39 -7.744 -12.057 4.600 1.00 0.00 H new ATOM 549 N SER A 40 -9.082 -14.150 2.554 1.00 0.00 N ATOM 550 CA SER A 40 -10.527 -13.976 2.469 1.00 0.00 C ATOM 551 C SER A 40 -10.937 -12.587 2.948 1.00 0.00 C ATOM 552 O SER A 40 -11.783 -11.932 2.339 1.00 0.00 O ATOM 553 CB SER A 40 -11.240 -15.045 3.300 1.00 0.00 C ATOM 554 OG SER A 40 -11.105 -16.326 2.708 1.00 0.00 O ATOM 0 H SER A 40 -8.784 -15.095 2.795 1.00 0.00 H new ATOM 0 HA SER A 40 -10.820 -14.082 1.424 1.00 0.00 H new ATOM 0 HB2 SER A 40 -10.827 -15.062 4.308 1.00 0.00 H new ATOM 0 HB3 SER A 40 -12.296 -14.793 3.393 1.00 0.00 H new ATOM 0 HG SER A 40 -11.568 -16.991 3.259 1.00 0.00 H new ATOM 560 N HIS A 41 -10.331 -12.144 4.045 1.00 0.00 N ATOM 561 CA HIS A 41 -10.631 -10.832 4.608 1.00 0.00 C ATOM 562 C HIS A 41 -10.851 -9.804 3.501 1.00 0.00 C ATOM 563 O HIS A 41 -11.963 -9.309 3.311 1.00 0.00 O ATOM 564 CB HIS A 41 -9.497 -10.375 5.525 1.00 0.00 C ATOM 565 CG HIS A 41 -9.834 -9.161 6.336 1.00 0.00 C ATOM 566 ND1 HIS A 41 -10.558 -8.100 5.836 1.00 0.00 N ATOM 567 CD2 HIS A 41 -9.542 -8.845 7.619 1.00 0.00 C ATOM 568 CE1 HIS A 41 -10.696 -7.182 6.776 1.00 0.00 C ATOM 569 NE2 HIS A 41 -10.089 -7.610 7.868 1.00 0.00 N ATOM 0 H HIS A 41 -9.629 -12.674 4.562 1.00 0.00 H new ATOM 0 HA HIS A 41 -11.548 -10.915 5.191 1.00 0.00 H new ATOM 0 HB2 HIS A 41 -9.235 -11.191 6.199 1.00 0.00 H new ATOM 0 HB3 HIS A 41 -8.615 -10.165 4.921 1.00 0.00 H new ATOM 0 HD2 HIS A 41 -8.983 -9.451 8.317 1.00 0.00 H new ATOM 0 HE1 HIS A 41 -11.217 -6.242 6.670 1.00 0.00 H new ATOM 0 HE2 HIS A 41 -10.035 -7.105 8.753 1.00 0.00 H new ATOM 578 N THR A 42 -9.785 -9.487 2.774 1.00 0.00 N ATOM 579 CA THR A 42 -9.861 -8.517 1.689 1.00 0.00 C ATOM 580 C THR A 42 -9.926 -9.212 0.334 1.00 0.00 C ATOM 581 O THR A 42 -9.306 -8.770 -0.632 1.00 0.00 O ATOM 582 CB THR A 42 -8.654 -7.560 1.705 1.00 0.00 C ATOM 583 OG1 THR A 42 -7.456 -8.277 1.388 1.00 0.00 O ATOM 584 CG2 THR A 42 -8.509 -6.895 3.065 1.00 0.00 C ATOM 0 H THR A 42 -8.858 -9.888 2.917 1.00 0.00 H new ATOM 0 HA THR A 42 -10.774 -7.941 1.843 1.00 0.00 H new ATOM 0 HB THR A 42 -8.822 -6.786 0.956 1.00 0.00 H new ATOM 0 HG1 THR A 42 -6.694 -7.661 1.399 1.00 0.00 H new ATOM 0 HG21 THR A 42 -7.650 -6.224 3.052 1.00 0.00 H new ATOM 0 HG22 THR A 42 -9.411 -6.326 3.290 1.00 0.00 H new ATOM 0 HG23 THR A 42 -8.362 -7.658 3.829 1.00 0.00 H new ATOM 592 N GLY A 43 -10.682 -10.305 0.269 1.00 0.00 N ATOM 593 CA GLY A 43 -10.814 -11.043 -0.973 1.00 0.00 C ATOM 594 C GLY A 43 -9.505 -11.662 -1.421 1.00 0.00 C ATOM 595 O GLY A 43 -9.296 -12.865 -1.269 1.00 0.00 O ATOM 0 H GLY A 43 -11.205 -10.692 1.055 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -11.560 -11.828 -0.848 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -11.182 -10.375 -1.752 1.00 0.00 H new ATOM 599 N GLU A 44 -8.622 -10.838 -1.977 1.00 0.00 N ATOM 600 CA GLU A 44 -7.327 -11.313 -2.451 1.00 0.00 C ATOM 601 C GLU A 44 -6.433 -10.144 -2.854 1.00 0.00 C ATOM 602 O GLU A 44 -6.828 -9.291 -3.648 1.00 0.00 O ATOM 603 CB GLU A 44 -7.511 -12.261 -3.638 1.00 0.00 C ATOM 604 CG GLU A 44 -6.210 -12.620 -4.337 1.00 0.00 C ATOM 605 CD GLU A 44 -6.417 -13.567 -5.504 1.00 0.00 C ATOM 606 OE1 GLU A 44 -6.595 -14.778 -5.261 1.00 0.00 O ATOM 607 OE2 GLU A 44 -6.401 -13.095 -6.660 1.00 0.00 O ATOM 0 H GLU A 44 -8.780 -9.839 -2.110 1.00 0.00 H new ATOM 0 HA GLU A 44 -6.845 -11.852 -1.635 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -7.992 -13.176 -3.291 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -8.186 -11.800 -4.359 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -5.730 -11.709 -4.694 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -5.530 -13.078 -3.619 1.00 0.00 H new ATOM 614 N ALA A 45 -5.225 -10.112 -2.299 1.00 0.00 N ATOM 615 CA ALA A 45 -4.274 -9.050 -2.600 1.00 0.00 C ATOM 616 C ALA A 45 -2.868 -9.426 -2.144 1.00 0.00 C ATOM 617 O ALA A 45 -2.580 -9.451 -0.948 1.00 0.00 O ATOM 618 CB ALA A 45 -4.712 -7.748 -1.947 1.00 0.00 C ATOM 0 H ALA A 45 -4.883 -10.810 -1.639 1.00 0.00 H new ATOM 0 HA ALA A 45 -4.252 -8.912 -3.681 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -3.992 -6.964 -2.180 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -5.694 -7.464 -2.325 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -4.764 -7.882 -0.867 1.00 0.00 H new ATOM 624 N SER A 46 -1.998 -9.719 -3.105 1.00 0.00 N ATOM 625 CA SER A 46 -0.623 -10.098 -2.801 1.00 0.00 C ATOM 626 C SER A 46 0.363 -9.257 -3.606 1.00 0.00 C ATOM 627 O SER A 46 0.099 -8.898 -4.753 1.00 0.00 O ATOM 628 CB SER A 46 -0.404 -11.583 -3.097 1.00 0.00 C ATOM 629 OG SER A 46 -0.815 -11.907 -4.414 1.00 0.00 O ATOM 0 H SER A 46 -2.221 -9.701 -4.100 1.00 0.00 H new ATOM 0 HA SER A 46 -0.448 -9.916 -1.741 1.00 0.00 H new ATOM 0 HB2 SER A 46 0.650 -11.831 -2.970 1.00 0.00 H new ATOM 0 HB3 SER A 46 -0.961 -12.186 -2.380 1.00 0.00 H new ATOM 0 HG SER A 46 -0.663 -12.861 -4.579 1.00 0.00 H new ATOM 635 N GLY A 47 1.503 -8.947 -2.996 1.00 0.00 N ATOM 636 CA GLY A 47 2.512 -8.151 -3.669 1.00 0.00 C ATOM 637 C GLY A 47 3.181 -7.156 -2.740 1.00 0.00 C ATOM 638 O GLY A 47 2.998 -7.213 -1.524 1.00 0.00 O ATOM 0 H GLY A 47 1.745 -9.233 -2.047 1.00 0.00 H new ATOM 0 HA2 GLY A 47 3.268 -8.812 -4.094 1.00 0.00 H new ATOM 0 HA3 GLY A 47 2.053 -7.616 -4.500 1.00 0.00 H new ATOM 642 N ILE A 48 3.958 -6.244 -3.314 1.00 0.00 N ATOM 643 CA ILE A 48 4.656 -5.234 -2.529 1.00 0.00 C ATOM 644 C ILE A 48 3.870 -3.928 -2.489 1.00 0.00 C ATOM 645 O ILE A 48 3.495 -3.385 -3.529 1.00 0.00 O ATOM 646 CB ILE A 48 6.063 -4.956 -3.092 1.00 0.00 C ATOM 647 CG1 ILE A 48 6.848 -6.262 -3.229 1.00 0.00 C ATOM 648 CG2 ILE A 48 6.807 -3.976 -2.198 1.00 0.00 C ATOM 649 CD1 ILE A 48 7.303 -6.835 -1.905 1.00 0.00 C ATOM 0 H ILE A 48 4.120 -6.184 -4.319 1.00 0.00 H new ATOM 0 HA ILE A 48 4.750 -5.630 -1.518 1.00 0.00 H new ATOM 0 HB ILE A 48 5.961 -4.510 -4.081 1.00 0.00 H new ATOM 0 HG12 ILE A 48 6.227 -6.998 -3.740 1.00 0.00 H new ATOM 0 HG13 ILE A 48 7.720 -6.088 -3.859 1.00 0.00 H new ATOM 0 HG21 ILE A 48 7.799 -3.790 -2.609 1.00 0.00 H new ATOM 0 HG22 ILE A 48 6.254 -3.038 -2.146 1.00 0.00 H new ATOM 0 HG23 ILE A 48 6.902 -4.397 -1.197 1.00 0.00 H new ATOM 0 HD11 ILE A 48 7.853 -7.760 -2.079 1.00 0.00 H new ATOM 0 HD12 ILE A 48 7.950 -6.117 -1.401 1.00 0.00 H new ATOM 0 HD13 ILE A 48 6.434 -7.041 -1.280 1.00 0.00 H new ATOM 661 N TYR A 49 3.625 -3.427 -1.283 1.00 0.00 N ATOM 662 CA TYR A 49 2.883 -2.185 -1.108 1.00 0.00 C ATOM 663 C TYR A 49 3.649 -1.215 -0.213 1.00 0.00 C ATOM 664 O TYR A 49 4.481 -1.623 0.596 1.00 0.00 O ATOM 665 CB TYR A 49 1.505 -2.470 -0.508 1.00 0.00 C ATOM 666 CG TYR A 49 0.610 -3.290 -1.410 1.00 0.00 C ATOM 667 CD1 TYR A 49 0.924 -4.608 -1.719 1.00 0.00 C ATOM 668 CD2 TYR A 49 -0.547 -2.748 -1.953 1.00 0.00 C ATOM 669 CE1 TYR A 49 0.110 -5.362 -2.543 1.00 0.00 C ATOM 670 CE2 TYR A 49 -1.368 -3.494 -2.777 1.00 0.00 C ATOM 671 CZ TYR A 49 -1.035 -4.800 -3.069 1.00 0.00 C ATOM 672 OH TYR A 49 -1.849 -5.546 -3.890 1.00 0.00 O ATOM 0 H TYR A 49 3.930 -3.862 -0.412 1.00 0.00 H new ATOM 0 HA TYR A 49 2.757 -1.725 -2.088 1.00 0.00 H new ATOM 0 HB2 TYR A 49 1.632 -2.995 0.439 1.00 0.00 H new ATOM 0 HB3 TYR A 49 1.013 -1.524 -0.284 1.00 0.00 H new ATOM 0 HD1 TYR A 49 1.819 -5.051 -1.308 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -0.810 -1.725 -1.727 1.00 0.00 H new ATOM 0 HE1 TYR A 49 0.369 -6.385 -2.774 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -2.265 -3.057 -3.190 1.00 0.00 H new ATOM 0 HH TYR A 49 -2.613 -5.003 -4.174 1.00 0.00 H new ATOM 682 N VAL A 50 3.359 0.074 -0.364 1.00 0.00 N ATOM 683 CA VAL A 50 4.017 1.104 0.430 1.00 0.00 C ATOM 684 C VAL A 50 3.488 1.118 1.860 1.00 0.00 C ATOM 685 O VAL A 50 2.336 1.478 2.104 1.00 0.00 O ATOM 686 CB VAL A 50 3.825 2.500 -0.190 1.00 0.00 C ATOM 687 CG1 VAL A 50 4.452 3.568 0.693 1.00 0.00 C ATOM 688 CG2 VAL A 50 4.411 2.545 -1.593 1.00 0.00 C ATOM 0 H VAL A 50 2.672 0.429 -1.029 1.00 0.00 H new ATOM 0 HA VAL A 50 5.080 0.863 0.441 1.00 0.00 H new ATOM 0 HB VAL A 50 2.756 2.703 -0.261 1.00 0.00 H new ATOM 0 HG11 VAL A 50 4.306 4.548 0.238 1.00 0.00 H new ATOM 0 HG12 VAL A 50 3.981 3.550 1.676 1.00 0.00 H new ATOM 0 HG13 VAL A 50 5.519 3.372 0.799 1.00 0.00 H new ATOM 0 HG21 VAL A 50 4.266 3.539 -2.016 1.00 0.00 H new ATOM 0 HG22 VAL A 50 5.477 2.321 -1.550 1.00 0.00 H new ATOM 0 HG23 VAL A 50 3.910 1.807 -2.220 1.00 0.00 H new ATOM 698 N LYS A 51 4.336 0.722 2.803 1.00 0.00 N ATOM 699 CA LYS A 51 3.956 0.690 4.210 1.00 0.00 C ATOM 700 C LYS A 51 3.896 2.100 4.790 1.00 0.00 C ATOM 701 O LYS A 51 2.995 2.426 5.562 1.00 0.00 O ATOM 702 CB LYS A 51 4.948 -0.159 5.009 1.00 0.00 C ATOM 703 CG LYS A 51 4.579 -0.308 6.474 1.00 0.00 C ATOM 704 CD LYS A 51 3.445 -1.302 6.666 1.00 0.00 C ATOM 705 CE LYS A 51 3.403 -1.832 8.091 1.00 0.00 C ATOM 706 NZ LYS A 51 4.322 -2.988 8.281 1.00 0.00 N ATOM 0 H LYS A 51 5.292 0.418 2.618 1.00 0.00 H new ATOM 0 HA LYS A 51 2.964 0.243 4.282 1.00 0.00 H new ATOM 0 HB2 LYS A 51 5.013 -1.149 4.557 1.00 0.00 H new ATOM 0 HB3 LYS A 51 5.939 0.290 4.936 1.00 0.00 H new ATOM 0 HG2 LYS A 51 5.452 -0.637 7.038 1.00 0.00 H new ATOM 0 HG3 LYS A 51 4.286 0.662 6.877 1.00 0.00 H new ATOM 0 HD2 LYS A 51 2.496 -0.823 6.427 1.00 0.00 H new ATOM 0 HD3 LYS A 51 3.567 -2.133 5.971 1.00 0.00 H new ATOM 0 HE2 LYS A 51 3.675 -1.035 8.783 1.00 0.00 H new ATOM 0 HE3 LYS A 51 2.385 -2.134 8.336 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 4.264 -3.320 9.265 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 4.048 -3.759 7.639 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 5.297 -2.694 8.072 1.00 0.00 H new ATOM 720 N SER A 52 4.862 2.932 4.412 1.00 0.00 N ATOM 721 CA SER A 52 4.920 4.306 4.896 1.00 0.00 C ATOM 722 C SER A 52 5.865 5.144 4.041 1.00 0.00 C ATOM 723 O SER A 52 6.596 4.616 3.203 1.00 0.00 O ATOM 724 CB SER A 52 5.374 4.335 6.357 1.00 0.00 C ATOM 725 OG SER A 52 4.268 4.236 7.237 1.00 0.00 O ATOM 0 H SER A 52 5.615 2.678 3.772 1.00 0.00 H new ATOM 0 HA SER A 52 3.920 4.733 4.825 1.00 0.00 H new ATOM 0 HB2 SER A 52 6.065 3.513 6.543 1.00 0.00 H new ATOM 0 HB3 SER A 52 5.918 5.259 6.554 1.00 0.00 H new ATOM 0 HG SER A 52 3.609 3.614 6.865 1.00 0.00 H new ATOM 731 N VAL A 53 5.844 6.455 4.259 1.00 0.00 N ATOM 732 CA VAL A 53 6.700 7.368 3.509 1.00 0.00 C ATOM 733 C VAL A 53 7.415 8.340 4.441 1.00 0.00 C ATOM 734 O VAL A 53 6.813 9.288 4.946 1.00 0.00 O ATOM 735 CB VAL A 53 5.892 8.169 2.471 1.00 0.00 C ATOM 736 CG1 VAL A 53 6.804 9.100 1.687 1.00 0.00 C ATOM 737 CG2 VAL A 53 5.145 7.229 1.537 1.00 0.00 C ATOM 0 H VAL A 53 5.244 6.909 4.948 1.00 0.00 H new ATOM 0 HA VAL A 53 7.438 6.757 2.990 1.00 0.00 H new ATOM 0 HB VAL A 53 5.158 8.778 2.999 1.00 0.00 H new ATOM 0 HG11 VAL A 53 6.215 9.658 0.958 1.00 0.00 H new ATOM 0 HG12 VAL A 53 7.288 9.796 2.372 1.00 0.00 H new ATOM 0 HG13 VAL A 53 7.563 8.514 1.168 1.00 0.00 H new ATOM 0 HG21 VAL A 53 4.579 7.812 0.810 1.00 0.00 H new ATOM 0 HG22 VAL A 53 5.859 6.592 1.015 1.00 0.00 H new ATOM 0 HG23 VAL A 53 4.461 6.609 2.116 1.00 0.00 H new ATOM 747 N ILE A 54 8.702 8.099 4.663 1.00 0.00 N ATOM 748 CA ILE A 54 9.500 8.954 5.533 1.00 0.00 C ATOM 749 C ILE A 54 9.377 10.419 5.127 1.00 0.00 C ATOM 750 O ILE A 54 9.539 10.782 3.962 1.00 0.00 O ATOM 751 CB ILE A 54 10.986 8.550 5.510 1.00 0.00 C ATOM 752 CG1 ILE A 54 11.162 7.138 6.073 1.00 0.00 C ATOM 753 CG2 ILE A 54 11.819 9.549 6.300 1.00 0.00 C ATOM 754 CD1 ILE A 54 10.921 6.047 5.053 1.00 0.00 C ATOM 0 H ILE A 54 9.215 7.319 4.253 1.00 0.00 H new ATOM 0 HA ILE A 54 9.112 8.825 6.544 1.00 0.00 H new ATOM 0 HB ILE A 54 11.333 8.555 4.477 1.00 0.00 H new ATOM 0 HG12 ILE A 54 12.172 7.037 6.470 1.00 0.00 H new ATOM 0 HG13 ILE A 54 10.476 7.001 6.909 1.00 0.00 H new ATOM 0 HG21 ILE A 54 12.867 9.250 6.274 1.00 0.00 H new ATOM 0 HG22 ILE A 54 11.714 10.540 5.859 1.00 0.00 H new ATOM 0 HG23 ILE A 54 11.474 9.574 7.334 1.00 0.00 H new ATOM 0 HD11 ILE A 54 11.063 5.073 5.521 1.00 0.00 H new ATOM 0 HD12 ILE A 54 9.902 6.122 4.674 1.00 0.00 H new ATOM 0 HD13 ILE A 54 11.624 6.159 4.228 1.00 0.00 H new ATOM 766 N PRO A 55 9.084 11.283 6.110 1.00 0.00 N ATOM 767 CA PRO A 55 8.935 12.723 5.880 1.00 0.00 C ATOM 768 C PRO A 55 10.261 13.398 5.550 1.00 0.00 C ATOM 769 O PRO A 55 11.328 12.906 5.916 1.00 0.00 O ATOM 770 CB PRO A 55 8.389 13.240 7.214 1.00 0.00 C ATOM 771 CG PRO A 55 8.857 12.250 8.224 1.00 0.00 C ATOM 772 CD PRO A 55 8.877 10.920 7.522 1.00 0.00 C ATOM 0 HA PRO A 55 8.289 12.935 5.028 1.00 0.00 H new ATOM 0 HB2 PRO A 55 8.765 14.239 7.435 1.00 0.00 H new ATOM 0 HB3 PRO A 55 7.301 13.305 7.198 1.00 0.00 H new ATOM 0 HG2 PRO A 55 9.848 12.510 8.595 1.00 0.00 H new ATOM 0 HG3 PRO A 55 8.190 12.226 9.086 1.00 0.00 H new ATOM 0 HD2 PRO A 55 9.678 10.281 7.894 1.00 0.00 H new ATOM 0 HD3 PRO A 55 7.943 10.376 7.664 1.00 0.00 H new ATOM 780 N GLY A 56 10.188 14.529 4.854 1.00 0.00 N ATOM 781 CA GLY A 56 11.390 15.253 4.486 1.00 0.00 C ATOM 782 C GLY A 56 12.330 14.422 3.635 1.00 0.00 C ATOM 783 O GLY A 56 13.546 14.605 3.682 1.00 0.00 O ATOM 0 H GLY A 56 9.317 14.956 4.539 1.00 0.00 H new ATOM 0 HA2 GLY A 56 11.114 16.156 3.941 1.00 0.00 H new ATOM 0 HA3 GLY A 56 11.909 15.572 5.390 1.00 0.00 H new ATOM 787 N SER A 57 11.766 13.504 2.857 1.00 0.00 N ATOM 788 CA SER A 57 12.562 12.637 1.996 1.00 0.00 C ATOM 789 C SER A 57 12.249 12.896 0.526 1.00 0.00 C ATOM 790 O SER A 57 11.414 13.738 0.197 1.00 0.00 O ATOM 791 CB SER A 57 12.301 11.168 2.334 1.00 0.00 C ATOM 792 OG SER A 57 11.229 10.651 1.564 1.00 0.00 O ATOM 0 H SER A 57 10.760 13.341 2.805 1.00 0.00 H new ATOM 0 HA SER A 57 13.614 12.861 2.170 1.00 0.00 H new ATOM 0 HB2 SER A 57 13.202 10.583 2.148 1.00 0.00 H new ATOM 0 HB3 SER A 57 12.071 11.071 3.395 1.00 0.00 H new ATOM 0 HG SER A 57 11.573 9.993 0.924 1.00 0.00 H new ATOM 798 N ALA A 58 12.927 12.167 -0.354 1.00 0.00 N ATOM 799 CA ALA A 58 12.721 12.315 -1.790 1.00 0.00 C ATOM 800 C ALA A 58 11.286 11.972 -2.177 1.00 0.00 C ATOM 801 O ALA A 58 10.608 12.756 -2.840 1.00 0.00 O ATOM 802 CB ALA A 58 13.701 11.440 -2.557 1.00 0.00 C ATOM 0 H ALA A 58 13.624 11.468 -0.098 1.00 0.00 H new ATOM 0 HA ALA A 58 12.901 13.358 -2.052 1.00 0.00 H new ATOM 0 HB1 ALA A 58 13.536 11.561 -3.628 1.00 0.00 H new ATOM 0 HB2 ALA A 58 14.721 11.735 -2.312 1.00 0.00 H new ATOM 0 HB3 ALA A 58 13.549 10.396 -2.282 1.00 0.00 H new ATOM 808 N ALA A 59 10.831 10.795 -1.760 1.00 0.00 N ATOM 809 CA ALA A 59 9.477 10.349 -2.062 1.00 0.00 C ATOM 810 C ALA A 59 8.444 11.351 -1.558 1.00 0.00 C ATOM 811 O ALA A 59 7.486 11.676 -2.261 1.00 0.00 O ATOM 812 CB ALA A 59 9.225 8.977 -1.453 1.00 0.00 C ATOM 0 H ALA A 59 11.381 10.133 -1.212 1.00 0.00 H new ATOM 0 HA ALA A 59 9.377 10.278 -3.145 1.00 0.00 H new ATOM 0 HB1 ALA A 59 8.210 8.656 -1.686 1.00 0.00 H new ATOM 0 HB2 ALA A 59 9.936 8.260 -1.864 1.00 0.00 H new ATOM 0 HB3 ALA A 59 9.349 9.031 -0.371 1.00 0.00 H new ATOM 818 N TYR A 60 8.643 11.836 -0.338 1.00 0.00 N ATOM 819 CA TYR A 60 7.726 12.799 0.260 1.00 0.00 C ATOM 820 C TYR A 60 7.742 14.117 -0.509 1.00 0.00 C ATOM 821 O TYR A 60 6.693 14.644 -0.882 1.00 0.00 O ATOM 822 CB TYR A 60 8.097 13.046 1.724 1.00 0.00 C ATOM 823 CG TYR A 60 7.294 14.151 2.373 1.00 0.00 C ATOM 824 CD1 TYR A 60 7.729 15.470 2.330 1.00 0.00 C ATOM 825 CD2 TYR A 60 6.102 13.875 3.031 1.00 0.00 C ATOM 826 CE1 TYR A 60 6.999 16.482 2.923 1.00 0.00 C ATOM 827 CE2 TYR A 60 5.365 14.881 3.625 1.00 0.00 C ATOM 828 CZ TYR A 60 5.818 16.183 3.569 1.00 0.00 C ATOM 829 OH TYR A 60 5.087 17.188 4.161 1.00 0.00 O ATOM 0 H TYR A 60 9.431 11.578 0.256 1.00 0.00 H new ATOM 0 HA TYR A 60 6.720 12.383 0.211 1.00 0.00 H new ATOM 0 HB2 TYR A 60 7.953 12.124 2.287 1.00 0.00 H new ATOM 0 HB3 TYR A 60 9.157 13.294 1.785 1.00 0.00 H new ATOM 0 HD1 TYR A 60 8.653 15.708 1.825 1.00 0.00 H new ATOM 0 HD2 TYR A 60 5.746 12.857 3.079 1.00 0.00 H new ATOM 0 HE1 TYR A 60 7.351 17.502 2.881 1.00 0.00 H new ATOM 0 HE2 TYR A 60 4.439 14.650 4.131 1.00 0.00 H new ATOM 0 HH TYR A 60 4.282 16.809 4.572 1.00 0.00 H new ATOM 839 N HIS A 61 8.939 14.644 -0.743 1.00 0.00 N ATOM 840 CA HIS A 61 9.093 15.900 -1.470 1.00 0.00 C ATOM 841 C HIS A 61 8.315 15.867 -2.782 1.00 0.00 C ATOM 842 O HIS A 61 7.546 16.780 -3.081 1.00 0.00 O ATOM 843 CB HIS A 61 10.571 16.175 -1.746 1.00 0.00 C ATOM 844 CG HIS A 61 11.265 16.899 -0.633 1.00 0.00 C ATOM 845 ND1 HIS A 61 10.606 17.728 0.250 1.00 0.00 N ATOM 846 CD2 HIS A 61 12.566 16.912 -0.261 1.00 0.00 C ATOM 847 CE1 HIS A 61 11.473 18.222 1.116 1.00 0.00 C ATOM 848 NE2 HIS A 61 12.669 17.742 0.828 1.00 0.00 N ATOM 0 H HIS A 61 9.817 14.222 -0.440 1.00 0.00 H new ATOM 0 HA HIS A 61 8.692 16.702 -0.851 1.00 0.00 H new ATOM 0 HB2 HIS A 61 11.081 15.228 -1.926 1.00 0.00 H new ATOM 0 HB3 HIS A 61 10.658 16.762 -2.660 1.00 0.00 H new ATOM 0 HD2 HIS A 61 13.373 16.371 -0.733 1.00 0.00 H new ATOM 0 HE1 HIS A 61 11.243 18.903 1.922 1.00 0.00 H new ATOM 0 HE2 HIS A 61 13.530 17.954 1.333 1.00 0.00 H new ATOM 857 N ASN A 62 8.522 14.811 -3.561 1.00 0.00 N ATOM 858 CA ASN A 62 7.841 14.660 -4.842 1.00 0.00 C ATOM 859 C ASN A 62 6.333 14.833 -4.680 1.00 0.00 C ATOM 860 O ASN A 62 5.736 15.740 -5.258 1.00 0.00 O ATOM 861 CB ASN A 62 8.146 13.289 -5.447 1.00 0.00 C ATOM 862 CG ASN A 62 8.057 13.293 -6.961 1.00 0.00 C ATOM 863 OD1 ASN A 62 8.403 14.279 -7.612 1.00 0.00 O ATOM 864 ND2 ASN A 62 7.591 12.187 -7.529 1.00 0.00 N ATOM 0 H ASN A 62 9.156 14.047 -3.328 1.00 0.00 H new ATOM 0 HA ASN A 62 8.208 15.436 -5.514 1.00 0.00 H new ATOM 0 HB2 ASN A 62 9.145 12.976 -5.145 1.00 0.00 H new ATOM 0 HB3 ASN A 62 7.447 12.554 -5.047 1.00 0.00 H new ATOM 0 HD21 ASN A 62 7.508 12.131 -8.544 1.00 0.00 H new ATOM 0 HD22 ASN A 62 7.316 11.393 -6.950 1.00 0.00 H new ATOM 871 N GLY A 63 5.724 13.956 -3.888 1.00 0.00 N ATOM 872 CA GLY A 63 4.292 14.029 -3.663 1.00 0.00 C ATOM 873 C GLY A 63 3.509 13.167 -4.633 1.00 0.00 C ATOM 874 O GLY A 63 2.346 13.449 -4.926 1.00 0.00 O ATOM 0 H GLY A 63 6.197 13.196 -3.398 1.00 0.00 H new ATOM 0 HA2 GLY A 63 4.071 13.715 -2.643 1.00 0.00 H new ATOM 0 HA3 GLY A 63 3.965 15.065 -3.756 1.00 0.00 H new ATOM 878 N HIS A 64 4.146 12.114 -5.135 1.00 0.00 N ATOM 879 CA HIS A 64 3.501 11.209 -6.079 1.00 0.00 C ATOM 880 C HIS A 64 3.338 9.818 -5.473 1.00 0.00 C ATOM 881 O HIS A 64 2.356 9.125 -5.741 1.00 0.00 O ATOM 882 CB HIS A 64 4.313 11.123 -7.372 1.00 0.00 C ATOM 883 CG HIS A 64 4.182 12.334 -8.243 1.00 0.00 C ATOM 884 ND1 HIS A 64 4.213 12.278 -9.620 1.00 0.00 N ATOM 885 CD2 HIS A 64 4.016 13.640 -7.925 1.00 0.00 C ATOM 886 CE1 HIS A 64 4.075 13.497 -10.112 1.00 0.00 C ATOM 887 NE2 HIS A 64 3.952 14.341 -9.104 1.00 0.00 N ATOM 0 H HIS A 64 5.108 11.867 -4.904 1.00 0.00 H new ATOM 0 HA HIS A 64 2.511 11.605 -6.306 1.00 0.00 H new ATOM 0 HB2 HIS A 64 5.364 10.977 -7.122 1.00 0.00 H new ATOM 0 HB3 HIS A 64 3.994 10.245 -7.934 1.00 0.00 H new ATOM 0 HD2 HIS A 64 3.947 14.053 -6.930 1.00 0.00 H new ATOM 0 HE1 HIS A 64 4.065 13.758 -11.160 1.00 0.00 H new ATOM 0 HE2 HIS A 64 3.829 15.350 -9.188 1.00 0.00 H new ATOM 896 N ILE A 65 4.307 9.416 -4.657 1.00 0.00 N ATOM 897 CA ILE A 65 4.270 8.109 -4.014 1.00 0.00 C ATOM 898 C ILE A 65 3.744 8.213 -2.587 1.00 0.00 C ATOM 899 O ILE A 65 4.303 8.934 -1.761 1.00 0.00 O ATOM 900 CB ILE A 65 5.664 7.454 -3.990 1.00 0.00 C ATOM 901 CG1 ILE A 65 6.172 7.232 -5.416 1.00 0.00 C ATOM 902 CG2 ILE A 65 5.618 6.138 -3.227 1.00 0.00 C ATOM 903 CD1 ILE A 65 7.678 7.128 -5.511 1.00 0.00 C ATOM 0 H ILE A 65 5.127 9.977 -4.426 1.00 0.00 H new ATOM 0 HA ILE A 65 3.596 7.487 -4.602 1.00 0.00 H new ATOM 0 HB ILE A 65 6.355 8.124 -3.479 1.00 0.00 H new ATOM 0 HG12 ILE A 65 5.727 6.320 -5.814 1.00 0.00 H new ATOM 0 HG13 ILE A 65 5.832 8.054 -6.046 1.00 0.00 H new ATOM 0 HG21 ILE A 65 6.610 5.687 -3.219 1.00 0.00 H new ATOM 0 HG22 ILE A 65 5.295 6.323 -2.202 1.00 0.00 H new ATOM 0 HG23 ILE A 65 4.916 5.460 -3.712 1.00 0.00 H new ATOM 0 HD11 ILE A 65 7.967 6.971 -6.550 1.00 0.00 H new ATOM 0 HD12 ILE A 65 8.130 8.049 -5.144 1.00 0.00 H new ATOM 0 HD13 ILE A 65 8.024 6.289 -4.908 1.00 0.00 H new ATOM 915 N GLN A 66 2.668 7.486 -2.304 1.00 0.00 N ATOM 916 CA GLN A 66 2.068 7.496 -0.975 1.00 0.00 C ATOM 917 C GLN A 66 1.660 6.089 -0.551 1.00 0.00 C ATOM 918 O GLN A 66 1.745 5.144 -1.336 1.00 0.00 O ATOM 919 CB GLN A 66 0.851 8.422 -0.949 1.00 0.00 C ATOM 920 CG GLN A 66 1.071 9.736 -1.680 1.00 0.00 C ATOM 921 CD GLN A 66 0.693 9.659 -3.146 1.00 0.00 C ATOM 922 OE1 GLN A 66 -0.157 8.859 -3.538 1.00 0.00 O ATOM 923 NE2 GLN A 66 1.322 10.494 -3.965 1.00 0.00 N ATOM 0 H GLN A 66 2.194 6.883 -2.977 1.00 0.00 H new ATOM 0 HA GLN A 66 2.813 7.866 -0.271 1.00 0.00 H new ATOM 0 HB2 GLN A 66 0.002 7.905 -1.396 1.00 0.00 H new ATOM 0 HB3 GLN A 66 0.587 8.632 0.087 1.00 0.00 H new ATOM 0 HG2 GLN A 66 0.484 10.518 -1.198 1.00 0.00 H new ATOM 0 HG3 GLN A 66 2.119 10.024 -1.594 1.00 0.00 H new ATOM 0 HE21 GLN A 66 2.020 11.141 -3.597 1.00 0.00 H new ATOM 0 HE22 GLN A 66 1.107 10.489 -4.962 1.00 0.00 H new ATOM 932 N VAL A 67 1.218 5.956 0.695 1.00 0.00 N ATOM 933 CA VAL A 67 0.796 4.664 1.223 1.00 0.00 C ATOM 934 C VAL A 67 -0.411 4.127 0.462 1.00 0.00 C ATOM 935 O VAL A 67 -0.989 4.820 -0.374 1.00 0.00 O ATOM 936 CB VAL A 67 0.445 4.757 2.720 1.00 0.00 C ATOM 937 CG1 VAL A 67 1.655 5.204 3.526 1.00 0.00 C ATOM 938 CG2 VAL A 67 -0.727 5.703 2.935 1.00 0.00 C ATOM 0 H VAL A 67 1.143 6.727 1.358 1.00 0.00 H new ATOM 0 HA VAL A 67 1.636 3.981 1.096 1.00 0.00 H new ATOM 0 HB VAL A 67 0.152 3.767 3.068 1.00 0.00 H new ATOM 0 HG11 VAL A 67 1.388 5.264 4.581 1.00 0.00 H new ATOM 0 HG12 VAL A 67 2.464 4.485 3.397 1.00 0.00 H new ATOM 0 HG13 VAL A 67 1.982 6.184 3.178 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -0.961 5.756 3.998 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -0.464 6.696 2.571 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -1.596 5.335 2.390 1.00 0.00 H new ATOM 948 N ASN A 68 -0.787 2.887 0.759 1.00 0.00 N ATOM 949 CA ASN A 68 -1.926 2.256 0.103 1.00 0.00 C ATOM 950 C ASN A 68 -1.685 2.125 -1.398 1.00 0.00 C ATOM 951 O ASN A 68 -2.586 2.355 -2.205 1.00 0.00 O ATOM 952 CB ASN A 68 -3.200 3.064 0.357 1.00 0.00 C ATOM 953 CG ASN A 68 -3.686 2.943 1.789 1.00 0.00 C ATOM 954 OD1 ASN A 68 -3.679 1.857 2.368 1.00 0.00 O ATOM 955 ND2 ASN A 68 -4.110 4.061 2.366 1.00 0.00 N ATOM 0 H ASN A 68 -0.319 2.300 1.450 1.00 0.00 H new ATOM 0 HA ASN A 68 -2.047 1.257 0.523 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -3.014 4.113 0.127 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -3.984 2.724 -0.320 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -4.448 4.042 3.328 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -4.098 4.939 1.847 1.00 0.00 H new ATOM 962 N ASP A 69 -0.463 1.752 -1.765 1.00 0.00 N ATOM 963 CA ASP A 69 -0.103 1.588 -3.169 1.00 0.00 C ATOM 964 C ASP A 69 0.586 0.248 -3.399 1.00 0.00 C ATOM 965 O ASP A 69 1.040 -0.400 -2.456 1.00 0.00 O ATOM 966 CB ASP A 69 0.809 2.730 -3.620 1.00 0.00 C ATOM 967 CG ASP A 69 0.036 3.986 -3.970 1.00 0.00 C ATOM 968 OD1 ASP A 69 -1.186 3.883 -4.205 1.00 0.00 O ATOM 969 OD2 ASP A 69 0.652 5.071 -4.009 1.00 0.00 O ATOM 0 H ASP A 69 0.294 1.558 -1.110 1.00 0.00 H new ATOM 0 HA ASP A 69 -1.019 1.611 -3.760 1.00 0.00 H new ATOM 0 HB2 ASP A 69 1.523 2.955 -2.828 1.00 0.00 H new ATOM 0 HB3 ASP A 69 1.386 2.409 -4.487 1.00 0.00 H new ATOM 974 N LYS A 70 0.661 -0.164 -4.661 1.00 0.00 N ATOM 975 CA LYS A 70 1.295 -1.428 -5.017 1.00 0.00 C ATOM 976 C LYS A 70 2.400 -1.211 -6.046 1.00 0.00 C ATOM 977 O LYS A 70 2.161 -0.659 -7.120 1.00 0.00 O ATOM 978 CB LYS A 70 0.255 -2.406 -5.569 1.00 0.00 C ATOM 979 CG LYS A 70 0.589 -3.863 -5.303 1.00 0.00 C ATOM 980 CD LYS A 70 1.701 -4.356 -6.214 1.00 0.00 C ATOM 981 CE LYS A 70 1.150 -4.889 -7.528 1.00 0.00 C ATOM 982 NZ LYS A 70 0.350 -6.129 -7.332 1.00 0.00 N ATOM 0 H LYS A 70 0.290 0.360 -5.454 1.00 0.00 H new ATOM 0 HA LYS A 70 1.739 -1.850 -4.115 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -0.716 -2.178 -5.128 1.00 0.00 H new ATOM 0 HB3 LYS A 70 0.160 -2.254 -6.644 1.00 0.00 H new ATOM 0 HG2 LYS A 70 0.890 -3.984 -4.262 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -0.301 -4.474 -5.451 1.00 0.00 H new ATOM 0 HD2 LYS A 70 2.397 -3.541 -6.414 1.00 0.00 H new ATOM 0 HD3 LYS A 70 2.265 -5.141 -5.710 1.00 0.00 H new ATOM 0 HE2 LYS A 70 0.528 -4.126 -7.997 1.00 0.00 H new ATOM 0 HE3 LYS A 70 1.974 -5.093 -8.211 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 0.336 -6.677 -8.216 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 0.777 -6.702 -6.576 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -0.623 -5.876 -7.066 1.00 0.00 H new ATOM 996 N ILE A 71 3.609 -1.649 -5.710 1.00 0.00 N ATOM 997 CA ILE A 71 4.750 -1.504 -6.605 1.00 0.00 C ATOM 998 C ILE A 71 4.852 -2.688 -7.561 1.00 0.00 C ATOM 999 O ILE A 71 4.760 -3.844 -7.147 1.00 0.00 O ATOM 1000 CB ILE A 71 6.069 -1.376 -5.821 1.00 0.00 C ATOM 1001 CG1 ILE A 71 5.988 -0.213 -4.830 1.00 0.00 C ATOM 1002 CG2 ILE A 71 7.237 -1.185 -6.777 1.00 0.00 C ATOM 1003 CD1 ILE A 71 5.462 -0.614 -3.470 1.00 0.00 C ATOM 0 H ILE A 71 3.823 -2.107 -4.824 1.00 0.00 H new ATOM 0 HA ILE A 71 4.588 -0.591 -7.177 1.00 0.00 H new ATOM 0 HB ILE A 71 6.232 -2.296 -5.259 1.00 0.00 H new ATOM 0 HG12 ILE A 71 6.980 0.224 -4.713 1.00 0.00 H new ATOM 0 HG13 ILE A 71 5.345 0.563 -5.245 1.00 0.00 H new ATOM 0 HG21 ILE A 71 8.162 -1.096 -6.208 1.00 0.00 H new ATOM 0 HG22 ILE A 71 7.304 -2.043 -7.446 1.00 0.00 H new ATOM 0 HG23 ILE A 71 7.083 -0.279 -7.363 1.00 0.00 H new ATOM 0 HD11 ILE A 71 5.432 0.260 -2.819 1.00 0.00 H new ATOM 0 HD12 ILE A 71 4.457 -1.023 -3.575 1.00 0.00 H new ATOM 0 HD13 ILE A 71 6.117 -1.368 -3.034 1.00 0.00 H new ATOM 1015 N VAL A 72 5.044 -2.392 -8.843 1.00 0.00 N ATOM 1016 CA VAL A 72 5.162 -3.432 -9.858 1.00 0.00 C ATOM 1017 C VAL A 72 6.544 -3.418 -10.501 1.00 0.00 C ATOM 1018 O VAL A 72 7.006 -4.430 -11.027 1.00 0.00 O ATOM 1019 CB VAL A 72 4.095 -3.268 -10.956 1.00 0.00 C ATOM 1020 CG1 VAL A 72 2.738 -3.740 -10.457 1.00 0.00 C ATOM 1021 CG2 VAL A 72 4.027 -1.822 -11.421 1.00 0.00 C ATOM 0 H VAL A 72 5.121 -1.441 -9.203 1.00 0.00 H new ATOM 0 HA VAL A 72 5.009 -4.386 -9.353 1.00 0.00 H new ATOM 0 HB VAL A 72 4.378 -3.887 -11.808 1.00 0.00 H new ATOM 0 HG11 VAL A 72 1.997 -3.616 -11.247 1.00 0.00 H new ATOM 0 HG12 VAL A 72 2.799 -4.792 -10.178 1.00 0.00 H new ATOM 0 HG13 VAL A 72 2.445 -3.150 -9.588 1.00 0.00 H new ATOM 0 HG21 VAL A 72 3.268 -1.725 -12.197 1.00 0.00 H new ATOM 0 HG22 VAL A 72 3.769 -1.181 -10.578 1.00 0.00 H new ATOM 0 HG23 VAL A 72 4.996 -1.523 -11.821 1.00 0.00 H new ATOM 1031 N ALA A 73 7.200 -2.263 -10.455 1.00 0.00 N ATOM 1032 CA ALA A 73 8.531 -2.117 -11.032 1.00 0.00 C ATOM 1033 C ALA A 73 9.302 -0.988 -10.355 1.00 0.00 C ATOM 1034 O ALA A 73 8.721 0.021 -9.956 1.00 0.00 O ATOM 1035 CB ALA A 73 8.433 -1.867 -12.529 1.00 0.00 C ATOM 0 H ALA A 73 6.832 -1.415 -10.024 1.00 0.00 H new ATOM 0 HA ALA A 73 9.076 -3.046 -10.865 1.00 0.00 H new ATOM 0 HB1 ALA A 73 9.434 -1.760 -12.946 1.00 0.00 H new ATOM 0 HB2 ALA A 73 7.929 -2.708 -13.006 1.00 0.00 H new ATOM 0 HB3 ALA A 73 7.865 -0.954 -12.709 1.00 0.00 H new ATOM 1041 N VAL A 74 10.613 -1.167 -10.227 1.00 0.00 N ATOM 1042 CA VAL A 74 11.463 -0.163 -9.598 1.00 0.00 C ATOM 1043 C VAL A 74 12.671 0.158 -10.470 1.00 0.00 C ATOM 1044 O VAL A 74 13.487 -0.716 -10.765 1.00 0.00 O ATOM 1045 CB VAL A 74 11.952 -0.630 -8.214 1.00 0.00 C ATOM 1046 CG1 VAL A 74 12.848 0.424 -7.581 1.00 0.00 C ATOM 1047 CG2 VAL A 74 10.770 -0.948 -7.311 1.00 0.00 C ATOM 0 H VAL A 74 11.109 -1.997 -10.550 1.00 0.00 H new ATOM 0 HA VAL A 74 10.857 0.735 -9.477 1.00 0.00 H new ATOM 0 HB VAL A 74 12.537 -1.541 -8.343 1.00 0.00 H new ATOM 0 HG11 VAL A 74 13.184 0.077 -6.604 1.00 0.00 H new ATOM 0 HG12 VAL A 74 13.713 0.598 -8.221 1.00 0.00 H new ATOM 0 HG13 VAL A 74 12.290 1.353 -7.464 1.00 0.00 H new ATOM 0 HG21 VAL A 74 11.134 -1.276 -6.337 1.00 0.00 H new ATOM 0 HG22 VAL A 74 10.156 -0.056 -7.187 1.00 0.00 H new ATOM 0 HG23 VAL A 74 10.171 -1.740 -7.761 1.00 0.00 H new ATOM 1057 N ASP A 75 12.780 1.417 -10.880 1.00 0.00 N ATOM 1058 CA ASP A 75 13.891 1.854 -11.718 1.00 0.00 C ATOM 1059 C ASP A 75 13.910 1.089 -13.037 1.00 0.00 C ATOM 1060 O ASP A 75 14.970 0.866 -13.621 1.00 0.00 O ATOM 1061 CB ASP A 75 15.219 1.663 -10.983 1.00 0.00 C ATOM 1062 CG ASP A 75 15.590 2.864 -10.136 1.00 0.00 C ATOM 1063 OD1 ASP A 75 16.096 3.856 -10.702 1.00 0.00 O ATOM 1064 OD2 ASP A 75 15.374 2.812 -8.907 1.00 0.00 O ATOM 0 H ASP A 75 12.113 2.153 -10.646 1.00 0.00 H new ATOM 0 HA ASP A 75 13.755 2.913 -11.935 1.00 0.00 H new ATOM 0 HB2 ASP A 75 15.155 0.780 -10.348 1.00 0.00 H new ATOM 0 HB3 ASP A 75 16.010 1.477 -11.710 1.00 0.00 H new ATOM 1069 N GLY A 76 12.730 0.689 -13.502 1.00 0.00 N ATOM 1070 CA GLY A 76 12.634 -0.047 -14.748 1.00 0.00 C ATOM 1071 C GLY A 76 12.871 -1.533 -14.563 1.00 0.00 C ATOM 1072 O GLY A 76 13.192 -2.242 -15.518 1.00 0.00 O ATOM 0 H GLY A 76 11.839 0.862 -13.037 1.00 0.00 H new ATOM 0 HA2 GLY A 76 11.647 0.109 -15.183 1.00 0.00 H new ATOM 0 HA3 GLY A 76 13.361 0.348 -15.457 1.00 0.00 H new ATOM 1076 N VAL A 77 12.715 -2.007 -13.331 1.00 0.00 N ATOM 1077 CA VAL A 77 12.914 -3.418 -13.024 1.00 0.00 C ATOM 1078 C VAL A 77 11.637 -4.047 -12.478 1.00 0.00 C ATOM 1079 O VAL A 77 11.188 -3.714 -11.382 1.00 0.00 O ATOM 1080 CB VAL A 77 14.048 -3.615 -12.000 1.00 0.00 C ATOM 1081 CG1 VAL A 77 14.199 -5.086 -11.646 1.00 0.00 C ATOM 1082 CG2 VAL A 77 15.354 -3.050 -12.537 1.00 0.00 C ATOM 0 H VAL A 77 12.451 -1.434 -12.529 1.00 0.00 H new ATOM 0 HA VAL A 77 13.188 -3.909 -13.958 1.00 0.00 H new ATOM 0 HB VAL A 77 13.791 -3.072 -11.090 1.00 0.00 H new ATOM 0 HG11 VAL A 77 15.005 -5.205 -10.922 1.00 0.00 H new ATOM 0 HG12 VAL A 77 13.267 -5.454 -11.216 1.00 0.00 H new ATOM 0 HG13 VAL A 77 14.433 -5.655 -12.546 1.00 0.00 H new ATOM 0 HG21 VAL A 77 16.144 -3.198 -11.801 1.00 0.00 H new ATOM 0 HG22 VAL A 77 15.619 -3.562 -13.462 1.00 0.00 H new ATOM 0 HG23 VAL A 77 15.236 -1.984 -12.734 1.00 0.00 H new ATOM 1092 N ASN A 78 11.057 -4.960 -13.251 1.00 0.00 N ATOM 1093 CA ASN A 78 9.831 -5.637 -12.846 1.00 0.00 C ATOM 1094 C ASN A 78 10.052 -6.446 -11.572 1.00 0.00 C ATOM 1095 O ASN A 78 10.429 -7.617 -11.626 1.00 0.00 O ATOM 1096 CB ASN A 78 9.335 -6.553 -13.966 1.00 0.00 C ATOM 1097 CG ASN A 78 8.111 -7.352 -13.561 1.00 0.00 C ATOM 1098 OD1 ASN A 78 8.225 -8.433 -12.983 1.00 0.00 O ATOM 1099 ND2 ASN A 78 6.932 -6.822 -13.864 1.00 0.00 N ATOM 0 H ASN A 78 11.417 -5.248 -14.161 1.00 0.00 H new ATOM 0 HA ASN A 78 9.075 -4.877 -12.646 1.00 0.00 H new ATOM 0 HB2 ASN A 78 9.099 -5.953 -14.845 1.00 0.00 H new ATOM 0 HB3 ASN A 78 10.134 -7.237 -14.252 1.00 0.00 H new ATOM 0 HD21 ASN A 78 6.073 -7.314 -13.617 1.00 0.00 H new ATOM 0 HD22 ASN A 78 6.885 -5.923 -14.344 1.00 0.00 H new ATOM 1106 N ILE A 79 9.814 -5.815 -10.427 1.00 0.00 N ATOM 1107 CA ILE A 79 9.986 -6.477 -9.140 1.00 0.00 C ATOM 1108 C ILE A 79 8.743 -7.275 -8.763 1.00 0.00 C ATOM 1109 O ILE A 79 8.591 -7.701 -7.618 1.00 0.00 O ATOM 1110 CB ILE A 79 10.290 -5.462 -8.022 1.00 0.00 C ATOM 1111 CG1 ILE A 79 9.091 -4.538 -7.802 1.00 0.00 C ATOM 1112 CG2 ILE A 79 11.533 -4.655 -8.362 1.00 0.00 C ATOM 1113 CD1 ILE A 79 8.990 -4.004 -6.390 1.00 0.00 C ATOM 0 H ILE A 79 9.501 -4.846 -10.365 1.00 0.00 H new ATOM 0 HA ILE A 79 10.833 -7.155 -9.244 1.00 0.00 H new ATOM 0 HB ILE A 79 10.478 -6.008 -7.098 1.00 0.00 H new ATOM 0 HG12 ILE A 79 9.157 -3.699 -8.495 1.00 0.00 H new ATOM 0 HG13 ILE A 79 8.176 -5.080 -8.043 1.00 0.00 H new ATOM 0 HG21 ILE A 79 11.734 -3.942 -7.562 1.00 0.00 H new ATOM 0 HG22 ILE A 79 12.384 -5.327 -8.472 1.00 0.00 H new ATOM 0 HG23 ILE A 79 11.373 -4.116 -9.296 1.00 0.00 H new ATOM 0 HD11 ILE A 79 8.117 -3.357 -6.307 1.00 0.00 H new ATOM 0 HD12 ILE A 79 8.892 -4.836 -5.693 1.00 0.00 H new ATOM 0 HD13 ILE A 79 9.888 -3.434 -6.151 1.00 0.00 H new ATOM 1125 N GLN A 80 7.858 -7.476 -9.734 1.00 0.00 N ATOM 1126 CA GLN A 80 6.628 -8.225 -9.503 1.00 0.00 C ATOM 1127 C GLN A 80 6.932 -9.610 -8.940 1.00 0.00 C ATOM 1128 O GLN A 80 7.229 -10.543 -9.686 1.00 0.00 O ATOM 1129 CB GLN A 80 5.833 -8.354 -10.803 1.00 0.00 C ATOM 1130 CG GLN A 80 5.176 -7.056 -11.245 1.00 0.00 C ATOM 1131 CD GLN A 80 3.954 -7.286 -12.112 1.00 0.00 C ATOM 1132 OE1 GLN A 80 3.106 -8.123 -11.801 1.00 0.00 O ATOM 1133 NE2 GLN A 80 3.856 -6.542 -13.208 1.00 0.00 N ATOM 0 H GLN A 80 7.969 -7.131 -10.687 1.00 0.00 H new ATOM 0 HA GLN A 80 6.031 -7.678 -8.773 1.00 0.00 H new ATOM 0 HB2 GLN A 80 6.498 -8.702 -11.593 1.00 0.00 H new ATOM 0 HB3 GLN A 80 5.064 -9.116 -10.675 1.00 0.00 H new ATOM 0 HG2 GLN A 80 4.889 -6.480 -10.365 1.00 0.00 H new ATOM 0 HG3 GLN A 80 5.900 -6.456 -11.796 1.00 0.00 H new ATOM 0 HE21 GLN A 80 4.582 -5.860 -13.428 1.00 0.00 H new ATOM 0 HE22 GLN A 80 3.055 -6.653 -13.830 1.00 0.00 H new ATOM 1142 N GLY A 81 6.856 -9.736 -7.619 1.00 0.00 N ATOM 1143 CA GLY A 81 7.126 -11.010 -6.979 1.00 0.00 C ATOM 1144 C GLY A 81 8.365 -10.970 -6.107 1.00 0.00 C ATOM 1145 O GLY A 81 8.524 -11.790 -5.203 1.00 0.00 O ATOM 0 H GLY A 81 6.612 -8.979 -6.981 1.00 0.00 H new ATOM 0 HA2 GLY A 81 6.267 -11.297 -6.372 1.00 0.00 H new ATOM 0 HA3 GLY A 81 7.248 -11.778 -7.743 1.00 0.00 H new ATOM 1149 N PHE A 82 9.248 -10.015 -6.381 1.00 0.00 N ATOM 1150 CA PHE A 82 10.482 -9.873 -5.617 1.00 0.00 C ATOM 1151 C PHE A 82 10.199 -9.900 -4.117 1.00 0.00 C ATOM 1152 O PHE A 82 9.301 -9.213 -3.632 1.00 0.00 O ATOM 1153 CB PHE A 82 11.191 -8.570 -5.990 1.00 0.00 C ATOM 1154 CG PHE A 82 12.076 -8.693 -7.197 1.00 0.00 C ATOM 1155 CD1 PHE A 82 11.630 -9.345 -8.336 1.00 0.00 C ATOM 1156 CD2 PHE A 82 13.354 -8.158 -7.194 1.00 0.00 C ATOM 1157 CE1 PHE A 82 12.442 -9.460 -9.449 1.00 0.00 C ATOM 1158 CE2 PHE A 82 14.170 -8.270 -8.303 1.00 0.00 C ATOM 1159 CZ PHE A 82 13.714 -8.923 -9.432 1.00 0.00 C ATOM 0 H PHE A 82 9.132 -9.328 -7.126 1.00 0.00 H new ATOM 0 HA PHE A 82 11.130 -10.714 -5.862 1.00 0.00 H new ATOM 0 HB2 PHE A 82 10.443 -7.799 -6.175 1.00 0.00 H new ATOM 0 HB3 PHE A 82 11.790 -8.236 -5.143 1.00 0.00 H new ATOM 0 HD1 PHE A 82 10.637 -9.768 -8.354 1.00 0.00 H new ATOM 0 HD2 PHE A 82 13.717 -7.647 -6.314 1.00 0.00 H new ATOM 0 HE1 PHE A 82 12.082 -9.969 -10.331 1.00 0.00 H new ATOM 0 HE2 PHE A 82 15.164 -7.847 -8.288 1.00 0.00 H new ATOM 0 HZ PHE A 82 14.351 -9.013 -10.299 1.00 0.00 H new ATOM 1169 N ALA A 83 10.973 -10.699 -3.390 1.00 0.00 N ATOM 1170 CA ALA A 83 10.808 -10.815 -1.946 1.00 0.00 C ATOM 1171 C ALA A 83 11.074 -9.482 -1.254 1.00 0.00 C ATOM 1172 O ALA A 83 11.867 -8.672 -1.732 1.00 0.00 O ATOM 1173 CB ALA A 83 11.729 -11.892 -1.394 1.00 0.00 C ATOM 0 H ALA A 83 11.720 -11.275 -3.777 1.00 0.00 H new ATOM 0 HA ALA A 83 9.775 -11.099 -1.745 1.00 0.00 H new ATOM 0 HB1 ALA A 83 11.595 -11.967 -0.315 1.00 0.00 H new ATOM 0 HB2 ALA A 83 11.488 -12.849 -1.857 1.00 0.00 H new ATOM 0 HB3 ALA A 83 12.765 -11.633 -1.614 1.00 0.00 H new ATOM 1179 N ASN A 84 10.407 -9.263 -0.126 1.00 0.00 N ATOM 1180 CA ASN A 84 10.572 -8.027 0.631 1.00 0.00 C ATOM 1181 C ASN A 84 12.026 -7.566 0.611 1.00 0.00 C ATOM 1182 O ASN A 84 12.325 -6.437 0.223 1.00 0.00 O ATOM 1183 CB ASN A 84 10.107 -8.224 2.076 1.00 0.00 C ATOM 1184 CG ASN A 84 8.627 -7.944 2.250 1.00 0.00 C ATOM 1185 OD1 ASN A 84 7.856 -8.830 2.621 1.00 0.00 O ATOM 1186 ND2 ASN A 84 8.223 -6.708 1.983 1.00 0.00 N ATOM 0 H ASN A 84 9.748 -9.924 0.284 1.00 0.00 H new ATOM 0 HA ASN A 84 9.960 -7.258 0.161 1.00 0.00 H new ATOM 0 HB2 ASN A 84 10.320 -9.247 2.387 1.00 0.00 H new ATOM 0 HB3 ASN A 84 10.678 -7.566 2.731 1.00 0.00 H new ATOM 0 HD21 ASN A 84 7.238 -6.461 2.083 1.00 0.00 H new ATOM 0 HD22 ASN A 84 8.897 -6.006 1.678 1.00 0.00 H new ATOM 1193 N HIS A 85 12.926 -8.449 1.031 1.00 0.00 N ATOM 1194 CA HIS A 85 14.350 -8.134 1.060 1.00 0.00 C ATOM 1195 C HIS A 85 14.894 -7.943 -0.353 1.00 0.00 C ATOM 1196 O HIS A 85 15.704 -7.050 -0.601 1.00 0.00 O ATOM 1197 CB HIS A 85 15.125 -9.243 1.772 1.00 0.00 C ATOM 1198 CG HIS A 85 14.627 -10.620 1.456 1.00 0.00 C ATOM 1199 ND1 HIS A 85 13.677 -11.269 2.216 1.00 0.00 N ATOM 1200 CD2 HIS A 85 14.951 -11.470 0.454 1.00 0.00 C ATOM 1201 CE1 HIS A 85 13.439 -12.460 1.696 1.00 0.00 C ATOM 1202 NE2 HIS A 85 14.199 -12.607 0.626 1.00 0.00 N ATOM 0 H HIS A 85 12.695 -9.388 1.356 1.00 0.00 H new ATOM 0 HA HIS A 85 14.479 -7.201 1.609 1.00 0.00 H new ATOM 0 HB2 HIS A 85 16.177 -9.174 1.496 1.00 0.00 H new ATOM 0 HB3 HIS A 85 15.066 -9.082 2.849 1.00 0.00 H new ATOM 0 HD2 HIS A 85 15.667 -11.288 -0.334 1.00 0.00 H new ATOM 0 HE1 HIS A 85 12.742 -13.189 2.081 1.00 0.00 H new ATOM 0 HE2 HIS A 85 14.224 -13.431 0.025 1.00 0.00 H new ATOM 1211 N ASP A 86 14.443 -8.788 -1.274 1.00 0.00 N ATOM 1212 CA ASP A 86 14.883 -8.712 -2.662 1.00 0.00 C ATOM 1213 C ASP A 86 14.612 -7.329 -3.243 1.00 0.00 C ATOM 1214 O ASP A 86 15.372 -6.833 -4.075 1.00 0.00 O ATOM 1215 CB ASP A 86 14.179 -9.780 -3.501 1.00 0.00 C ATOM 1216 CG ASP A 86 14.791 -11.155 -3.321 1.00 0.00 C ATOM 1217 OD1 ASP A 86 15.978 -11.230 -2.939 1.00 0.00 O ATOM 1218 OD2 ASP A 86 14.085 -12.156 -3.563 1.00 0.00 O ATOM 0 H ASP A 86 13.773 -9.533 -1.084 1.00 0.00 H new ATOM 0 HA ASP A 86 15.958 -8.892 -2.688 1.00 0.00 H new ATOM 0 HB2 ASP A 86 13.125 -9.816 -3.227 1.00 0.00 H new ATOM 0 HB3 ASP A 86 14.225 -9.500 -4.553 1.00 0.00 H new ATOM 1223 N VAL A 87 13.521 -6.710 -2.801 1.00 0.00 N ATOM 1224 CA VAL A 87 13.149 -5.383 -3.278 1.00 0.00 C ATOM 1225 C VAL A 87 13.998 -4.303 -2.617 1.00 0.00 C ATOM 1226 O VAL A 87 14.368 -3.315 -3.251 1.00 0.00 O ATOM 1227 CB VAL A 87 11.662 -5.087 -3.008 1.00 0.00 C ATOM 1228 CG1 VAL A 87 11.332 -3.645 -3.361 1.00 0.00 C ATOM 1229 CG2 VAL A 87 10.778 -6.051 -3.786 1.00 0.00 C ATOM 0 H VAL A 87 12.880 -7.106 -2.114 1.00 0.00 H new ATOM 0 HA VAL A 87 13.325 -5.372 -4.354 1.00 0.00 H new ATOM 0 HB VAL A 87 11.468 -5.229 -1.945 1.00 0.00 H new ATOM 0 HG11 VAL A 87 10.277 -3.454 -3.164 1.00 0.00 H new ATOM 0 HG12 VAL A 87 11.941 -2.974 -2.756 1.00 0.00 H new ATOM 0 HG13 VAL A 87 11.541 -3.472 -4.417 1.00 0.00 H new ATOM 0 HG21 VAL A 87 9.730 -5.828 -3.584 1.00 0.00 H new ATOM 0 HG22 VAL A 87 10.973 -5.943 -4.853 1.00 0.00 H new ATOM 0 HG23 VAL A 87 10.997 -7.074 -3.479 1.00 0.00 H new ATOM 1239 N VAL A 88 14.305 -4.499 -1.338 1.00 0.00 N ATOM 1240 CA VAL A 88 15.113 -3.543 -0.591 1.00 0.00 C ATOM 1241 C VAL A 88 16.425 -3.251 -1.310 1.00 0.00 C ATOM 1242 O VAL A 88 16.786 -2.093 -1.517 1.00 0.00 O ATOM 1243 CB VAL A 88 15.422 -4.057 0.828 1.00 0.00 C ATOM 1244 CG1 VAL A 88 16.531 -3.233 1.465 1.00 0.00 C ATOM 1245 CG2 VAL A 88 14.167 -4.033 1.687 1.00 0.00 C ATOM 0 H VAL A 88 14.006 -5.311 -0.798 1.00 0.00 H new ATOM 0 HA VAL A 88 14.530 -2.625 -0.518 1.00 0.00 H new ATOM 0 HB VAL A 88 15.766 -5.089 0.756 1.00 0.00 H new ATOM 0 HG11 VAL A 88 16.735 -3.611 2.467 1.00 0.00 H new ATOM 0 HG12 VAL A 88 17.433 -3.307 0.858 1.00 0.00 H new ATOM 0 HG13 VAL A 88 16.220 -2.190 1.527 1.00 0.00 H new ATOM 0 HG21 VAL A 88 14.403 -4.399 2.686 1.00 0.00 H new ATOM 0 HG22 VAL A 88 13.791 -3.012 1.754 1.00 0.00 H new ATOM 0 HG23 VAL A 88 13.406 -4.671 1.237 1.00 0.00 H new ATOM 1255 N GLU A 89 17.134 -4.310 -1.690 1.00 0.00 N ATOM 1256 CA GLU A 89 18.407 -4.166 -2.387 1.00 0.00 C ATOM 1257 C GLU A 89 18.248 -3.308 -3.638 1.00 0.00 C ATOM 1258 O GLU A 89 19.072 -2.437 -3.916 1.00 0.00 O ATOM 1259 CB GLU A 89 18.965 -5.540 -2.764 1.00 0.00 C ATOM 1260 CG GLU A 89 18.509 -6.028 -4.129 1.00 0.00 C ATOM 1261 CD GLU A 89 18.922 -7.461 -4.404 1.00 0.00 C ATOM 1262 OE1 GLU A 89 18.931 -8.268 -3.451 1.00 0.00 O ATOM 1263 OE2 GLU A 89 19.235 -7.775 -5.571 1.00 0.00 O ATOM 0 H GLU A 89 16.849 -5.276 -1.527 1.00 0.00 H new ATOM 0 HA GLU A 89 19.107 -3.670 -1.714 1.00 0.00 H new ATOM 0 HB2 GLU A 89 20.054 -5.498 -2.748 1.00 0.00 H new ATOM 0 HB3 GLU A 89 18.663 -6.265 -2.009 1.00 0.00 H new ATOM 0 HG2 GLU A 89 17.424 -5.947 -4.196 1.00 0.00 H new ATOM 0 HG3 GLU A 89 18.925 -5.380 -4.900 1.00 0.00 H new ATOM 1270 N VAL A 90 17.183 -3.562 -4.391 1.00 0.00 N ATOM 1271 CA VAL A 90 16.914 -2.813 -5.613 1.00 0.00 C ATOM 1272 C VAL A 90 16.806 -1.319 -5.330 1.00 0.00 C ATOM 1273 O VAL A 90 17.200 -0.490 -6.152 1.00 0.00 O ATOM 1274 CB VAL A 90 15.616 -3.291 -6.291 1.00 0.00 C ATOM 1275 CG1 VAL A 90 15.293 -2.423 -7.497 1.00 0.00 C ATOM 1276 CG2 VAL A 90 15.732 -4.754 -6.692 1.00 0.00 C ATOM 0 H VAL A 90 16.492 -4.281 -4.176 1.00 0.00 H new ATOM 0 HA VAL A 90 17.753 -2.993 -6.285 1.00 0.00 H new ATOM 0 HB VAL A 90 14.798 -3.198 -5.577 1.00 0.00 H new ATOM 0 HG11 VAL A 90 14.373 -2.776 -7.963 1.00 0.00 H new ATOM 0 HG12 VAL A 90 15.165 -1.389 -7.177 1.00 0.00 H new ATOM 0 HG13 VAL A 90 16.110 -2.481 -8.217 1.00 0.00 H new ATOM 0 HG21 VAL A 90 14.806 -5.075 -7.169 1.00 0.00 H new ATOM 0 HG22 VAL A 90 16.561 -4.876 -7.389 1.00 0.00 H new ATOM 0 HG23 VAL A 90 15.912 -5.361 -5.805 1.00 0.00 H new ATOM 1286 N LEU A 91 16.271 -0.981 -4.162 1.00 0.00 N ATOM 1287 CA LEU A 91 16.112 0.415 -3.769 1.00 0.00 C ATOM 1288 C LEU A 91 17.460 1.044 -3.435 1.00 0.00 C ATOM 1289 O LEU A 91 17.752 2.166 -3.849 1.00 0.00 O ATOM 1290 CB LEU A 91 15.174 0.522 -2.565 1.00 0.00 C ATOM 1291 CG LEU A 91 13.799 -0.128 -2.725 1.00 0.00 C ATOM 1292 CD1 LEU A 91 13.091 -0.216 -1.382 1.00 0.00 C ATOM 1293 CD2 LEU A 91 12.956 0.649 -3.725 1.00 0.00 C ATOM 0 H LEU A 91 15.940 -1.654 -3.471 1.00 0.00 H new ATOM 0 HA LEU A 91 15.678 0.956 -4.610 1.00 0.00 H new ATOM 0 HB2 LEU A 91 15.668 0.072 -1.704 1.00 0.00 H new ATOM 0 HB3 LEU A 91 15.030 1.578 -2.335 1.00 0.00 H new ATOM 0 HG LEU A 91 13.938 -1.140 -3.106 1.00 0.00 H new ATOM 0 HD11 LEU A 91 12.114 -0.681 -1.515 1.00 0.00 H new ATOM 0 HD12 LEU A 91 13.688 -0.816 -0.695 1.00 0.00 H new ATOM 0 HD13 LEU A 91 12.963 0.786 -0.972 1.00 0.00 H new ATOM 0 HD21 LEU A 91 11.981 0.173 -3.827 1.00 0.00 H new ATOM 0 HD22 LEU A 91 12.825 1.672 -3.373 1.00 0.00 H new ATOM 0 HD23 LEU A 91 13.457 0.660 -4.693 1.00 0.00 H new ATOM 1305 N ARG A 92 18.280 0.313 -2.687 1.00 0.00 N ATOM 1306 CA ARG A 92 19.598 0.799 -2.299 1.00 0.00 C ATOM 1307 C ARG A 92 20.511 0.926 -3.515 1.00 0.00 C ATOM 1308 O ARG A 92 21.228 1.915 -3.665 1.00 0.00 O ATOM 1309 CB ARG A 92 20.230 -0.141 -1.270 1.00 0.00 C ATOM 1310 CG ARG A 92 21.180 -1.159 -1.879 1.00 0.00 C ATOM 1311 CD ARG A 92 21.569 -2.230 -0.871 1.00 0.00 C ATOM 1312 NE ARG A 92 22.312 -3.323 -1.493 1.00 0.00 N ATOM 1313 CZ ARG A 92 22.373 -4.550 -0.990 1.00 0.00 C ATOM 1314 NH1 ARG A 92 21.737 -4.840 0.137 1.00 0.00 N ATOM 1315 NH2 ARG A 92 23.070 -5.491 -1.614 1.00 0.00 N ATOM 0 H ARG A 92 18.054 -0.618 -2.338 1.00 0.00 H new ATOM 0 HA ARG A 92 19.476 1.786 -1.853 1.00 0.00 H new ATOM 0 HB2 ARG A 92 20.770 0.452 -0.532 1.00 0.00 H new ATOM 0 HB3 ARG A 92 19.438 -0.668 -0.737 1.00 0.00 H new ATOM 0 HG2 ARG A 92 20.709 -1.626 -2.744 1.00 0.00 H new ATOM 0 HG3 ARG A 92 22.076 -0.653 -2.238 1.00 0.00 H new ATOM 0 HD2 ARG A 92 22.174 -1.783 -0.082 1.00 0.00 H new ATOM 0 HD3 ARG A 92 20.670 -2.626 -0.398 1.00 0.00 H new ATOM 0 HE ARG A 92 22.812 -3.133 -2.362 1.00 0.00 H new ATOM 0 HH11 ARG A 92 21.200 -4.120 0.619 1.00 0.00 H new ATOM 0 HH12 ARG A 92 21.785 -5.783 0.522 1.00 0.00 H new ATOM 0 HH21 ARG A 92 23.560 -5.272 -2.481 1.00 0.00 H new ATOM 0 HH22 ARG A 92 23.116 -6.433 -1.226 1.00 0.00 H new ATOM 1329 N ASN A 93 20.477 -0.081 -4.381 1.00 0.00 N ATOM 1330 CA ASN A 93 21.302 -0.083 -5.584 1.00 0.00 C ATOM 1331 C ASN A 93 20.863 1.017 -6.546 1.00 0.00 C ATOM 1332 O ASN A 93 21.628 1.441 -7.411 1.00 0.00 O ATOM 1333 CB ASN A 93 21.225 -1.444 -6.278 1.00 0.00 C ATOM 1334 CG ASN A 93 22.145 -2.469 -5.644 1.00 0.00 C ATOM 1335 OD1 ASN A 93 23.296 -2.624 -6.051 1.00 0.00 O ATOM 1336 ND2 ASN A 93 21.639 -3.177 -4.640 1.00 0.00 N ATOM 0 H ASN A 93 19.887 -0.906 -4.273 1.00 0.00 H new ATOM 0 HA ASN A 93 22.333 0.108 -5.288 1.00 0.00 H new ATOM 0 HB2 ASN A 93 20.199 -1.810 -6.242 1.00 0.00 H new ATOM 0 HB3 ASN A 93 21.485 -1.328 -7.330 1.00 0.00 H new ATOM 0 HD21 ASN A 93 22.210 -3.882 -4.174 1.00 0.00 H new ATOM 0 HD22 ASN A 93 20.679 -3.015 -4.335 1.00 0.00 H new ATOM 1343 N ALA A 94 19.625 1.474 -6.388 1.00 0.00 N ATOM 1344 CA ALA A 94 19.084 2.525 -7.240 1.00 0.00 C ATOM 1345 C ALA A 94 19.859 3.827 -7.065 1.00 0.00 C ATOM 1346 O ALA A 94 20.371 4.115 -5.984 1.00 0.00 O ATOM 1347 CB ALA A 94 17.609 2.743 -6.939 1.00 0.00 C ATOM 0 H ALA A 94 18.978 1.132 -5.677 1.00 0.00 H new ATOM 0 HA ALA A 94 19.188 2.206 -8.277 1.00 0.00 H new ATOM 0 HB1 ALA A 94 17.219 3.531 -7.583 1.00 0.00 H new ATOM 0 HB2 ALA A 94 17.060 1.819 -7.122 1.00 0.00 H new ATOM 0 HB3 ALA A 94 17.490 3.035 -5.896 1.00 0.00 H new ATOM 1353 N GLY A 95 19.942 4.610 -8.136 1.00 0.00 N ATOM 1354 CA GLY A 95 20.658 5.871 -8.079 1.00 0.00 C ATOM 1355 C GLY A 95 19.731 7.055 -7.889 1.00 0.00 C ATOM 1356 O GLY A 95 18.591 6.895 -7.453 1.00 0.00 O ATOM 0 H GLY A 95 19.526 4.394 -9.042 1.00 0.00 H new ATOM 0 HA2 GLY A 95 21.377 5.841 -7.260 1.00 0.00 H new ATOM 0 HA3 GLY A 95 21.228 6.004 -8.998 1.00 0.00 H new ATOM 1360 N GLN A 96 20.221 8.247 -8.215 1.00 0.00 N ATOM 1361 CA GLN A 96 19.428 9.463 -8.075 1.00 0.00 C ATOM 1362 C GLN A 96 18.066 9.305 -8.742 1.00 0.00 C ATOM 1363 O GLN A 96 17.029 9.358 -8.080 1.00 0.00 O ATOM 1364 CB GLN A 96 20.171 10.654 -8.683 1.00 0.00 C ATOM 1365 CG GLN A 96 19.687 12.000 -8.168 1.00 0.00 C ATOM 1366 CD GLN A 96 20.755 13.073 -8.246 1.00 0.00 C ATOM 1367 OE1 GLN A 96 21.463 13.189 -9.247 1.00 0.00 O ATOM 1368 NE2 GLN A 96 20.876 13.866 -7.188 1.00 0.00 N ATOM 0 H GLN A 96 21.163 8.397 -8.578 1.00 0.00 H new ATOM 0 HA GLN A 96 19.272 9.644 -7.012 1.00 0.00 H new ATOM 0 HB2 GLN A 96 21.235 10.554 -8.471 1.00 0.00 H new ATOM 0 HB3 GLN A 96 20.058 10.627 -9.767 1.00 0.00 H new ATOM 0 HG2 GLN A 96 18.818 12.315 -8.746 1.00 0.00 H new ATOM 0 HG3 GLN A 96 19.360 11.893 -7.134 1.00 0.00 H new ATOM 0 HE21 GLN A 96 20.268 13.734 -6.380 1.00 0.00 H new ATOM 0 HE22 GLN A 96 21.577 14.607 -7.184 1.00 0.00 H new ATOM 1377 N VAL A 97 18.075 9.109 -10.057 1.00 0.00 N ATOM 1378 CA VAL A 97 16.840 8.943 -10.814 1.00 0.00 C ATOM 1379 C VAL A 97 16.186 7.600 -10.509 1.00 0.00 C ATOM 1380 O VAL A 97 16.557 6.573 -11.078 1.00 0.00 O ATOM 1381 CB VAL A 97 17.092 9.046 -12.329 1.00 0.00 C ATOM 1382 CG1 VAL A 97 15.810 8.781 -13.104 1.00 0.00 C ATOM 1383 CG2 VAL A 97 17.665 10.410 -12.682 1.00 0.00 C ATOM 0 H VAL A 97 18.924 9.061 -10.620 1.00 0.00 H new ATOM 0 HA VAL A 97 16.171 9.748 -10.509 1.00 0.00 H new ATOM 0 HB VAL A 97 17.821 8.286 -12.610 1.00 0.00 H new ATOM 0 HG11 VAL A 97 16.008 8.858 -14.173 1.00 0.00 H new ATOM 0 HG12 VAL A 97 15.446 7.780 -12.874 1.00 0.00 H new ATOM 0 HG13 VAL A 97 15.055 9.515 -12.821 1.00 0.00 H new ATOM 0 HG21 VAL A 97 17.837 10.465 -13.757 1.00 0.00 H new ATOM 0 HG22 VAL A 97 16.961 11.188 -12.387 1.00 0.00 H new ATOM 0 HG23 VAL A 97 18.608 10.556 -12.156 1.00 0.00 H new ATOM 1393 N VAL A 98 15.210 7.614 -9.606 1.00 0.00 N ATOM 1394 CA VAL A 98 14.502 6.397 -9.226 1.00 0.00 C ATOM 1395 C VAL A 98 13.085 6.388 -9.788 1.00 0.00 C ATOM 1396 O VAL A 98 12.206 7.097 -9.296 1.00 0.00 O ATOM 1397 CB VAL A 98 14.437 6.241 -7.695 1.00 0.00 C ATOM 1398 CG1 VAL A 98 13.656 4.991 -7.319 1.00 0.00 C ATOM 1399 CG2 VAL A 98 15.838 6.202 -7.104 1.00 0.00 C ATOM 0 H VAL A 98 14.892 8.455 -9.124 1.00 0.00 H new ATOM 0 HA VAL A 98 15.061 5.561 -9.645 1.00 0.00 H new ATOM 0 HB VAL A 98 13.916 7.104 -7.280 1.00 0.00 H new ATOM 0 HG11 VAL A 98 13.620 4.897 -6.234 1.00 0.00 H new ATOM 0 HG12 VAL A 98 12.641 5.064 -7.710 1.00 0.00 H new ATOM 0 HG13 VAL A 98 14.146 4.115 -7.743 1.00 0.00 H new ATOM 0 HG21 VAL A 98 15.773 6.091 -6.022 1.00 0.00 H new ATOM 0 HG22 VAL A 98 16.386 5.358 -7.523 1.00 0.00 H new ATOM 0 HG23 VAL A 98 16.360 7.128 -7.344 1.00 0.00 H new ATOM 1409 N HIS A 99 12.869 5.580 -10.821 1.00 0.00 N ATOM 1410 CA HIS A 99 11.557 5.477 -11.449 1.00 0.00 C ATOM 1411 C HIS A 99 10.700 4.426 -10.750 1.00 0.00 C ATOM 1412 O HIS A 99 10.784 3.236 -11.058 1.00 0.00 O ATOM 1413 CB HIS A 99 11.704 5.128 -12.931 1.00 0.00 C ATOM 1414 CG HIS A 99 12.012 6.310 -13.797 1.00 0.00 C ATOM 1415 ND1 HIS A 99 13.177 6.427 -14.525 1.00 0.00 N ATOM 1416 CD2 HIS A 99 11.297 7.432 -14.050 1.00 0.00 C ATOM 1417 CE1 HIS A 99 13.167 7.570 -15.188 1.00 0.00 C ATOM 1418 NE2 HIS A 99 12.037 8.198 -14.917 1.00 0.00 N ATOM 0 H HIS A 99 13.585 4.987 -11.241 1.00 0.00 H new ATOM 0 HA HIS A 99 11.061 6.443 -11.358 1.00 0.00 H new ATOM 0 HB2 HIS A 99 12.497 4.388 -13.045 1.00 0.00 H new ATOM 0 HB3 HIS A 99 10.782 4.663 -13.280 1.00 0.00 H new ATOM 0 HD2 HIS A 99 10.326 7.678 -13.646 1.00 0.00 H new ATOM 0 HE1 HIS A 99 13.949 7.929 -15.840 1.00 0.00 H new ATOM 0 HE2 HIS A 99 11.759 9.105 -15.291 1.00 0.00 H new ATOM 1427 N LEU A 100 9.879 4.872 -9.806 1.00 0.00 N ATOM 1428 CA LEU A 100 9.007 3.970 -9.062 1.00 0.00 C ATOM 1429 C LEU A 100 7.722 3.692 -9.836 1.00 0.00 C ATOM 1430 O LEU A 100 6.942 4.603 -10.115 1.00 0.00 O ATOM 1431 CB LEU A 100 8.672 4.566 -7.694 1.00 0.00 C ATOM 1432 CG LEU A 100 8.493 3.566 -6.551 1.00 0.00 C ATOM 1433 CD1 LEU A 100 7.342 2.617 -6.847 1.00 0.00 C ATOM 1434 CD2 LEU A 100 9.781 2.788 -6.317 1.00 0.00 C ATOM 0 H LEU A 100 9.799 5.853 -9.538 1.00 0.00 H new ATOM 0 HA LEU A 100 9.536 3.027 -8.922 1.00 0.00 H new ATOM 0 HB2 LEU A 100 9.464 5.263 -7.420 1.00 0.00 H new ATOM 0 HB3 LEU A 100 7.755 5.147 -7.788 1.00 0.00 H new ATOM 0 HG LEU A 100 8.256 4.120 -5.643 1.00 0.00 H new ATOM 0 HD11 LEU A 100 7.230 1.913 -6.023 1.00 0.00 H new ATOM 0 HD12 LEU A 100 6.421 3.188 -6.965 1.00 0.00 H new ATOM 0 HD13 LEU A 100 7.549 2.069 -7.766 1.00 0.00 H new ATOM 0 HD21 LEU A 100 9.636 2.081 -5.500 1.00 0.00 H new ATOM 0 HD22 LEU A 100 10.048 2.245 -7.224 1.00 0.00 H new ATOM 0 HD23 LEU A 100 10.583 3.480 -6.059 1.00 0.00 H new ATOM 1446 N THR A 101 7.506 2.426 -10.180 1.00 0.00 N ATOM 1447 CA THR A 101 6.316 2.027 -10.920 1.00 0.00 C ATOM 1448 C THR A 101 5.212 1.562 -9.978 1.00 0.00 C ATOM 1449 O THR A 101 5.378 0.586 -9.245 1.00 0.00 O ATOM 1450 CB THR A 101 6.629 0.900 -11.922 1.00 0.00 C ATOM 1451 OG1 THR A 101 7.857 1.178 -12.605 1.00 0.00 O ATOM 1452 CG2 THR A 101 5.503 0.746 -12.933 1.00 0.00 C ATOM 0 H THR A 101 8.141 1.659 -9.957 1.00 0.00 H new ATOM 0 HA THR A 101 5.976 2.906 -11.468 1.00 0.00 H new ATOM 0 HB THR A 101 6.726 -0.033 -11.367 1.00 0.00 H new ATOM 0 HG1 THR A 101 8.611 1.014 -12.001 1.00 0.00 H new ATOM 0 HG21 THR A 101 5.747 -0.056 -13.630 1.00 0.00 H new ATOM 0 HG22 THR A 101 4.577 0.504 -12.412 1.00 0.00 H new ATOM 0 HG23 THR A 101 5.377 1.679 -13.483 1.00 0.00 H new ATOM 1460 N LEU A 102 4.085 2.265 -10.001 1.00 0.00 N ATOM 1461 CA LEU A 102 2.952 1.923 -9.149 1.00 0.00 C ATOM 1462 C LEU A 102 1.677 1.773 -9.972 1.00 0.00 C ATOM 1463 O LEU A 102 1.539 2.375 -11.037 1.00 0.00 O ATOM 1464 CB LEU A 102 2.756 2.993 -8.074 1.00 0.00 C ATOM 1465 CG LEU A 102 4.008 3.400 -7.295 1.00 0.00 C ATOM 1466 CD1 LEU A 102 4.903 4.286 -8.148 1.00 0.00 C ATOM 1467 CD2 LEU A 102 3.626 4.109 -6.004 1.00 0.00 C ATOM 0 H LEU A 102 3.932 3.076 -10.601 1.00 0.00 H new ATOM 0 HA LEU A 102 3.166 0.968 -8.668 1.00 0.00 H new ATOM 0 HB2 LEU A 102 2.342 3.883 -8.547 1.00 0.00 H new ATOM 0 HB3 LEU A 102 2.011 2.634 -7.364 1.00 0.00 H new ATOM 0 HG LEU A 102 4.563 2.497 -7.039 1.00 0.00 H new ATOM 0 HD11 LEU A 102 5.789 4.566 -7.577 1.00 0.00 H new ATOM 0 HD12 LEU A 102 5.205 3.743 -9.044 1.00 0.00 H new ATOM 0 HD13 LEU A 102 4.358 5.185 -8.435 1.00 0.00 H new ATOM 0 HD21 LEU A 102 4.529 4.391 -5.463 1.00 0.00 H new ATOM 0 HD22 LEU A 102 3.048 5.003 -6.237 1.00 0.00 H new ATOM 0 HD23 LEU A 102 3.026 3.441 -5.386 1.00 0.00 H new ATOM 1479 N VAL A 103 0.745 0.969 -9.470 1.00 0.00 N ATOM 1480 CA VAL A 103 -0.521 0.742 -10.157 1.00 0.00 C ATOM 1481 C VAL A 103 -1.701 0.938 -9.212 1.00 0.00 C ATOM 1482 O VAL A 103 -1.959 0.105 -8.344 1.00 0.00 O ATOM 1483 CB VAL A 103 -0.588 -0.674 -10.758 1.00 0.00 C ATOM 1484 CG1 VAL A 103 -0.215 -1.716 -9.714 1.00 0.00 C ATOM 1485 CG2 VAL A 103 -1.973 -0.947 -11.324 1.00 0.00 C ATOM 0 H VAL A 103 0.843 0.464 -8.589 1.00 0.00 H new ATOM 0 HA VAL A 103 -0.579 1.473 -10.963 1.00 0.00 H new ATOM 0 HB VAL A 103 0.132 -0.738 -11.574 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -0.268 -2.710 -10.157 1.00 0.00 H new ATOM 0 HG12 VAL A 103 0.799 -1.530 -9.360 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -0.908 -1.655 -8.875 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -2.002 -1.952 -11.745 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -2.714 -0.865 -10.529 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -2.197 -0.220 -12.105 1.00 0.00 H new ATOM 1495 N ARG A 104 -2.415 2.045 -9.388 1.00 0.00 N ATOM 1496 CA ARG A 104 -3.569 2.351 -8.551 1.00 0.00 C ATOM 1497 C ARG A 104 -4.869 1.995 -9.265 1.00 0.00 C ATOM 1498 O ARG A 104 -4.920 1.943 -10.494 1.00 0.00 O ATOM 1499 CB ARG A 104 -3.572 3.834 -8.172 1.00 0.00 C ATOM 1500 CG ARG A 104 -2.362 4.256 -7.356 1.00 0.00 C ATOM 1501 CD ARG A 104 -2.320 5.764 -7.160 1.00 0.00 C ATOM 1502 NE ARG A 104 -2.341 6.481 -8.432 1.00 0.00 N ATOM 1503 CZ ARG A 104 -2.255 7.803 -8.532 1.00 0.00 C ATOM 1504 NH1 ARG A 104 -2.142 8.547 -7.440 1.00 0.00 N ATOM 1505 NH2 ARG A 104 -2.281 8.383 -9.725 1.00 0.00 N ATOM 0 H ARG A 104 -2.215 2.745 -10.103 1.00 0.00 H new ATOM 0 HA ARG A 104 -3.497 1.751 -7.644 1.00 0.00 H new ATOM 0 HB2 ARG A 104 -3.613 4.433 -9.082 1.00 0.00 H new ATOM 0 HB3 ARG A 104 -4.477 4.054 -7.605 1.00 0.00 H new ATOM 0 HG2 ARG A 104 -2.387 3.762 -6.385 1.00 0.00 H new ATOM 0 HG3 ARG A 104 -1.451 3.928 -7.857 1.00 0.00 H new ATOM 0 HD2 ARG A 104 -3.171 6.075 -6.554 1.00 0.00 H new ATOM 0 HD3 ARG A 104 -1.420 6.033 -6.607 1.00 0.00 H new ATOM 0 HE ARG A 104 -2.426 5.937 -9.291 1.00 0.00 H new ATOM 0 HH11 ARG A 104 -2.121 8.104 -6.521 1.00 0.00 H new ATOM 0 HH12 ARG A 104 -2.076 9.562 -7.519 1.00 0.00 H new ATOM 0 HH21 ARG A 104 -2.367 7.814 -10.567 1.00 0.00 H new ATOM 0 HH22 ARG A 104 -2.215 9.398 -9.800 1.00 0.00 H new ATOM 1519 N ARG A 105 -5.918 1.750 -8.487 1.00 0.00 N ATOM 1520 CA ARG A 105 -7.218 1.397 -9.045 1.00 0.00 C ATOM 1521 C ARG A 105 -7.900 2.620 -9.650 1.00 0.00 C ATOM 1522 O ARG A 105 -8.039 3.654 -8.996 1.00 0.00 O ATOM 1523 CB ARG A 105 -8.111 0.784 -7.965 1.00 0.00 C ATOM 1524 CG ARG A 105 -9.392 0.173 -8.509 1.00 0.00 C ATOM 1525 CD ARG A 105 -9.955 -0.876 -7.562 1.00 0.00 C ATOM 1526 NE ARG A 105 -10.453 -0.284 -6.323 1.00 0.00 N ATOM 1527 CZ ARG A 105 -11.201 -0.941 -5.444 1.00 0.00 C ATOM 1528 NH1 ARG A 105 -11.536 -2.204 -5.666 1.00 0.00 N ATOM 1529 NH2 ARG A 105 -11.616 -0.334 -4.340 1.00 0.00 N ATOM 0 H ARG A 105 -5.893 1.789 -7.468 1.00 0.00 H new ATOM 0 HA ARG A 105 -7.059 0.663 -9.835 1.00 0.00 H new ATOM 0 HB2 ARG A 105 -7.549 0.016 -7.434 1.00 0.00 H new ATOM 0 HB3 ARG A 105 -8.366 1.554 -7.236 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -10.132 0.957 -8.666 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -9.196 -0.280 -9.481 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -10.763 -1.415 -8.057 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -9.181 -1.607 -7.329 1.00 0.00 H new ATOM 0 HE ARG A 105 -10.213 0.687 -6.122 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -11.219 -2.674 -6.514 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -12.111 -2.706 -4.989 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -11.361 0.638 -4.166 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -12.190 -0.839 -3.665 1.00 0.00 H new ATOM 1543 N LYS A 106 -8.324 2.496 -10.903 1.00 0.00 N ATOM 1544 CA LYS A 106 -8.993 3.590 -11.597 1.00 0.00 C ATOM 1545 C LYS A 106 -10.328 3.918 -10.937 1.00 0.00 C ATOM 1546 O LYS A 106 -10.603 5.072 -10.606 1.00 0.00 O ATOM 1547 CB LYS A 106 -9.214 3.228 -13.068 1.00 0.00 C ATOM 1548 CG LYS A 106 -7.926 2.985 -13.835 1.00 0.00 C ATOM 1549 CD LYS A 106 -8.163 2.121 -15.062 1.00 0.00 C ATOM 1550 CE LYS A 106 -7.179 2.451 -16.174 1.00 0.00 C ATOM 1551 NZ LYS A 106 -7.648 1.950 -17.496 1.00 0.00 N ATOM 0 H LYS A 106 -8.216 1.648 -11.459 1.00 0.00 H new ATOM 0 HA LYS A 106 -8.353 4.470 -11.538 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -9.835 2.334 -13.124 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -9.769 4.032 -13.552 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -7.496 3.940 -14.138 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -7.199 2.501 -13.183 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -8.069 1.069 -14.792 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -9.182 2.268 -15.421 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -7.036 3.530 -16.224 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -6.209 2.012 -15.943 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -6.838 1.866 -18.143 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -8.093 1.018 -17.376 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -8.341 2.616 -17.894 1.00 0.00 H new ATOM 1565 N THR A 107 -11.156 2.895 -10.746 1.00 0.00 N ATOM 1566 CA THR A 107 -12.463 3.075 -10.125 1.00 0.00 C ATOM 1567 C THR A 107 -12.375 4.003 -8.919 1.00 0.00 C ATOM 1568 O THR A 107 -11.514 3.835 -8.055 1.00 0.00 O ATOM 1569 CB THR A 107 -13.063 1.728 -9.680 1.00 0.00 C ATOM 1570 OG1 THR A 107 -13.074 0.810 -10.778 1.00 0.00 O ATOM 1571 CG2 THR A 107 -14.478 1.914 -9.153 1.00 0.00 C ATOM 0 H THR A 107 -10.945 1.933 -11.012 1.00 0.00 H new ATOM 0 HA THR A 107 -13.112 3.523 -10.877 1.00 0.00 H new ATOM 0 HB THR A 107 -12.444 1.326 -8.878 1.00 0.00 H new ATOM 0 HG1 THR A 107 -13.455 -0.044 -10.486 1.00 0.00 H new ATOM 0 HG21 THR A 107 -14.881 0.949 -8.845 1.00 0.00 H new ATOM 0 HG22 THR A 107 -14.462 2.590 -8.298 1.00 0.00 H new ATOM 0 HG23 THR A 107 -15.106 2.336 -9.938 1.00 0.00 H new ATOM 1579 N SER A 108 -13.271 4.984 -8.867 1.00 0.00 N ATOM 1580 CA SER A 108 -13.292 5.941 -7.767 1.00 0.00 C ATOM 1581 C SER A 108 -13.191 5.227 -6.423 1.00 0.00 C ATOM 1582 O SER A 108 -13.670 4.104 -6.266 1.00 0.00 O ATOM 1583 CB SER A 108 -14.572 6.779 -7.818 1.00 0.00 C ATOM 1584 OG SER A 108 -15.715 5.980 -7.567 1.00 0.00 O ATOM 0 H SER A 108 -13.991 5.137 -9.573 1.00 0.00 H new ATOM 0 HA SER A 108 -12.430 6.599 -7.874 1.00 0.00 H new ATOM 0 HB2 SER A 108 -14.515 7.580 -7.081 1.00 0.00 H new ATOM 0 HB3 SER A 108 -14.662 7.251 -8.796 1.00 0.00 H new ATOM 0 HG SER A 108 -16.519 6.539 -7.603 1.00 0.00 H new ATOM 1590 N SER A 109 -12.564 5.888 -5.455 1.00 0.00 N ATOM 1591 CA SER A 109 -12.396 5.316 -4.124 1.00 0.00 C ATOM 1592 C SER A 109 -13.713 5.332 -3.355 1.00 0.00 C ATOM 1593 O SER A 109 -14.339 6.380 -3.196 1.00 0.00 O ATOM 1594 CB SER A 109 -11.328 6.087 -3.346 1.00 0.00 C ATOM 1595 OG SER A 109 -11.010 5.432 -2.130 1.00 0.00 O ATOM 0 H SER A 109 -12.164 6.820 -5.567 1.00 0.00 H new ATOM 0 HA SER A 109 -12.076 4.280 -4.238 1.00 0.00 H new ATOM 0 HB2 SER A 109 -10.430 6.185 -3.955 1.00 0.00 H new ATOM 0 HB3 SER A 109 -11.683 7.096 -3.137 1.00 0.00 H new ATOM 0 HG SER A 109 -10.324 5.944 -1.652 1.00 0.00 H new ATOM 1601 N SER A 110 -14.129 4.162 -2.880 1.00 0.00 N ATOM 1602 CA SER A 110 -15.374 4.040 -2.131 1.00 0.00 C ATOM 1603 C SER A 110 -15.277 4.768 -0.794 1.00 0.00 C ATOM 1604 O SER A 110 -14.834 4.201 0.206 1.00 0.00 O ATOM 1605 CB SER A 110 -15.711 2.566 -1.898 1.00 0.00 C ATOM 1606 OG SER A 110 -14.644 1.894 -1.251 1.00 0.00 O ATOM 0 H SER A 110 -13.622 3.285 -3.001 1.00 0.00 H new ATOM 0 HA SER A 110 -16.169 4.499 -2.718 1.00 0.00 H new ATOM 0 HB2 SER A 110 -16.614 2.488 -1.293 1.00 0.00 H new ATOM 0 HB3 SER A 110 -15.924 2.083 -2.852 1.00 0.00 H new ATOM 0 HG SER A 110 -14.335 2.428 -0.490 1.00 0.00 H new ATOM 1612 N THR A 111 -15.694 6.030 -0.783 1.00 0.00 N ATOM 1613 CA THR A 111 -15.654 6.838 0.430 1.00 0.00 C ATOM 1614 C THR A 111 -16.620 8.014 0.340 1.00 0.00 C ATOM 1615 O THR A 111 -16.662 8.719 -0.668 1.00 0.00 O ATOM 1616 CB THR A 111 -14.236 7.374 0.701 1.00 0.00 C ATOM 1617 OG1 THR A 111 -13.310 6.285 0.793 1.00 0.00 O ATOM 1618 CG2 THR A 111 -14.201 8.185 1.988 1.00 0.00 C ATOM 0 H THR A 111 -16.063 6.515 -1.601 1.00 0.00 H new ATOM 0 HA THR A 111 -15.953 6.188 1.252 1.00 0.00 H new ATOM 0 HB THR A 111 -13.952 8.023 -0.127 1.00 0.00 H new ATOM 0 HG1 THR A 111 -13.801 5.450 0.944 1.00 0.00 H new ATOM 0 HG21 THR A 111 -13.189 8.553 2.159 1.00 0.00 H new ATOM 0 HG22 THR A 111 -14.885 9.029 1.905 1.00 0.00 H new ATOM 0 HG23 THR A 111 -14.503 7.554 2.824 1.00 0.00 H new ATOM 1626 N SER A 112 -17.395 8.220 1.400 1.00 0.00 N ATOM 1627 CA SER A 112 -18.364 9.309 1.439 1.00 0.00 C ATOM 1628 C SER A 112 -17.908 10.408 2.394 1.00 0.00 C ATOM 1629 O SER A 112 -18.390 10.526 3.520 1.00 0.00 O ATOM 1630 CB SER A 112 -19.736 8.784 1.865 1.00 0.00 C ATOM 1631 OG SER A 112 -20.431 8.222 0.765 1.00 0.00 O ATOM 0 H SER A 112 -17.371 7.647 2.243 1.00 0.00 H new ATOM 0 HA SER A 112 -18.440 9.731 0.437 1.00 0.00 H new ATOM 0 HB2 SER A 112 -19.615 8.032 2.645 1.00 0.00 H new ATOM 0 HB3 SER A 112 -20.323 9.597 2.293 1.00 0.00 H new ATOM 0 HG SER A 112 -21.304 7.892 1.064 1.00 0.00 H new ATOM 1637 N PRO A 113 -16.954 11.232 1.934 1.00 0.00 N ATOM 1638 CA PRO A 113 -16.411 12.336 2.731 1.00 0.00 C ATOM 1639 C PRO A 113 -17.423 13.459 2.930 1.00 0.00 C ATOM 1640 O PRO A 113 -18.615 13.289 2.669 1.00 0.00 O ATOM 1641 CB PRO A 113 -15.226 12.826 1.896 1.00 0.00 C ATOM 1642 CG PRO A 113 -15.559 12.434 0.498 1.00 0.00 C ATOM 1643 CD PRO A 113 -16.333 11.149 0.602 1.00 0.00 C ATOM 0 HA PRO A 113 -16.138 12.017 3.737 1.00 0.00 H new ATOM 0 HB2 PRO A 113 -15.099 13.905 1.985 1.00 0.00 H new ATOM 0 HB3 PRO A 113 -14.294 12.367 2.224 1.00 0.00 H new ATOM 0 HG2 PRO A 113 -16.150 13.207 0.006 1.00 0.00 H new ATOM 0 HG3 PRO A 113 -14.655 12.298 -0.095 1.00 0.00 H new ATOM 0 HD2 PRO A 113 -17.082 11.066 -0.186 1.00 0.00 H new ATOM 0 HD3 PRO A 113 -15.682 10.279 0.516 1.00 0.00 H new ATOM 1651 N LEU A 114 -16.942 14.608 3.393 1.00 0.00 N ATOM 1652 CA LEU A 114 -17.805 15.760 3.626 1.00 0.00 C ATOM 1653 C LEU A 114 -18.097 16.495 2.322 1.00 0.00 C ATOM 1654 O LEU A 114 -19.207 16.983 2.109 1.00 0.00 O ATOM 1655 CB LEU A 114 -17.154 16.715 4.628 1.00 0.00 C ATOM 1656 CG LEU A 114 -15.892 17.433 4.148 1.00 0.00 C ATOM 1657 CD1 LEU A 114 -16.252 18.735 3.449 1.00 0.00 C ATOM 1658 CD2 LEU A 114 -14.950 17.695 5.315 1.00 0.00 C ATOM 0 H LEU A 114 -15.959 14.766 3.614 1.00 0.00 H new ATOM 0 HA LEU A 114 -18.748 15.399 4.037 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -17.890 17.467 4.913 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -16.908 16.152 5.528 1.00 0.00 H new ATOM 0 HG LEU A 114 -15.381 16.789 3.432 1.00 0.00 H new ATOM 0 HD11 LEU A 114 -15.342 19.232 3.114 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -16.887 18.523 2.589 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -16.786 19.385 4.142 1.00 0.00 H new ATOM 0 HD21 LEU A 114 -14.058 18.207 4.954 1.00 0.00 H new ATOM 0 HD22 LEU A 114 -15.452 18.319 6.055 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -14.665 16.748 5.773 1.00 0.00 H new ATOM 1670 N GLU A 115 -17.095 16.568 1.452 1.00 0.00 N ATOM 1671 CA GLU A 115 -17.246 17.242 0.168 1.00 0.00 C ATOM 1672 C GLU A 115 -16.811 16.333 -0.978 1.00 0.00 C ATOM 1673 O GLU A 115 -15.788 16.556 -1.627 1.00 0.00 O ATOM 1674 CB GLU A 115 -16.428 18.535 0.146 1.00 0.00 C ATOM 1675 CG GLU A 115 -16.552 19.312 -1.153 1.00 0.00 C ATOM 1676 CD GLU A 115 -15.841 20.651 -1.103 1.00 0.00 C ATOM 1677 OE1 GLU A 115 -16.410 21.604 -0.531 1.00 0.00 O ATOM 1678 OE2 GLU A 115 -14.715 20.745 -1.636 1.00 0.00 O ATOM 0 H GLU A 115 -16.170 16.169 1.613 1.00 0.00 H new ATOM 0 HA GLU A 115 -18.300 17.485 0.036 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -16.747 19.171 0.972 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -15.379 18.294 0.317 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -16.141 18.717 -1.968 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -17.607 19.473 -1.376 1.00 0.00 H new ATOM 1685 N PRO A 116 -17.605 15.283 -1.234 1.00 0.00 N ATOM 1686 CA PRO A 116 -17.323 14.319 -2.302 1.00 0.00 C ATOM 1687 C PRO A 116 -17.507 14.922 -3.691 1.00 0.00 C ATOM 1688 O PRO A 116 -18.326 15.816 -3.902 1.00 0.00 O ATOM 1689 CB PRO A 116 -18.351 13.211 -2.060 1.00 0.00 C ATOM 1690 CG PRO A 116 -19.472 13.883 -1.344 1.00 0.00 C ATOM 1691 CD PRO A 116 -18.840 14.957 -0.502 1.00 0.00 C ATOM 0 HA PRO A 116 -16.289 13.974 -2.277 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -18.688 12.772 -2.999 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -17.928 12.403 -1.463 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -20.186 14.309 -2.049 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -20.021 13.174 -0.725 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -19.491 15.826 -0.405 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -18.628 14.603 0.507 1.00 0.00 H new ATOM 1699 N PRO A 117 -16.729 14.422 -4.662 1.00 0.00 N ATOM 1700 CA PRO A 117 -16.789 14.896 -6.047 1.00 0.00 C ATOM 1701 C PRO A 117 -18.084 14.492 -6.743 1.00 0.00 C ATOM 1702 O PRO A 117 -18.998 13.958 -6.113 1.00 0.00 O ATOM 1703 CB PRO A 117 -15.590 14.211 -6.709 1.00 0.00 C ATOM 1704 CG PRO A 117 -15.353 12.989 -5.890 1.00 0.00 C ATOM 1705 CD PRO A 117 -15.730 13.354 -4.482 1.00 0.00 C ATOM 0 HA PRO A 117 -16.762 15.984 -6.106 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -15.803 13.957 -7.747 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -14.715 14.861 -6.713 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -15.954 12.155 -6.251 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -14.310 12.678 -5.946 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -16.145 12.502 -3.944 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -14.868 13.702 -3.913 1.00 0.00 H new ATOM 1713 N SER A 118 -18.156 14.748 -8.045 1.00 0.00 N ATOM 1714 CA SER A 118 -19.342 14.414 -8.826 1.00 0.00 C ATOM 1715 C SER A 118 -19.302 12.957 -9.276 1.00 0.00 C ATOM 1716 O SER A 118 -18.500 12.582 -10.132 1.00 0.00 O ATOM 1717 CB SER A 118 -19.453 15.334 -10.043 1.00 0.00 C ATOM 1718 OG SER A 118 -20.665 15.110 -10.742 1.00 0.00 O ATOM 0 H SER A 118 -17.407 15.186 -8.582 1.00 0.00 H new ATOM 0 HA SER A 118 -20.217 14.556 -8.192 1.00 0.00 H new ATOM 0 HB2 SER A 118 -19.401 16.374 -9.722 1.00 0.00 H new ATOM 0 HB3 SER A 118 -18.608 15.164 -10.710 1.00 0.00 H new ATOM 0 HG SER A 118 -20.713 15.711 -11.515 1.00 0.00 H new ATOM 1724 N ASP A 119 -20.173 12.140 -8.694 1.00 0.00 N ATOM 1725 CA ASP A 119 -20.240 10.724 -9.035 1.00 0.00 C ATOM 1726 C ASP A 119 -20.709 10.533 -10.474 1.00 0.00 C ATOM 1727 O ASP A 119 -21.561 11.276 -10.963 1.00 0.00 O ATOM 1728 CB ASP A 119 -21.179 9.990 -8.077 1.00 0.00 C ATOM 1729 CG ASP A 119 -20.927 10.353 -6.627 1.00 0.00 C ATOM 1730 OD1 ASP A 119 -19.802 10.110 -6.142 1.00 0.00 O ATOM 1731 OD2 ASP A 119 -21.853 10.881 -5.978 1.00 0.00 O ATOM 0 H ASP A 119 -20.843 12.434 -7.983 1.00 0.00 H new ATOM 0 HA ASP A 119 -19.238 10.305 -8.940 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -22.212 10.226 -8.333 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -21.057 8.915 -8.206 1.00 0.00 H new ATOM 1736 N ARG A 120 -20.148 9.534 -11.147 1.00 0.00 N ATOM 1737 CA ARG A 120 -20.508 9.248 -12.530 1.00 0.00 C ATOM 1738 C ARG A 120 -21.824 8.479 -12.602 1.00 0.00 C ATOM 1739 O ARG A 120 -22.365 8.059 -11.580 1.00 0.00 O ATOM 1740 CB ARG A 120 -19.398 8.445 -13.213 1.00 0.00 C ATOM 1741 CG ARG A 120 -19.271 7.021 -12.696 1.00 0.00 C ATOM 1742 CD ARG A 120 -18.414 6.169 -13.619 1.00 0.00 C ATOM 1743 NE ARG A 120 -16.989 6.323 -13.340 1.00 0.00 N ATOM 1744 CZ ARG A 120 -16.377 5.756 -12.306 1.00 0.00 C ATOM 1745 NH1 ARG A 120 -17.062 5.000 -11.459 1.00 0.00 N ATOM 1746 NH2 ARG A 120 -15.077 5.943 -12.119 1.00 0.00 N ATOM 0 H ARG A 120 -19.442 8.909 -10.757 1.00 0.00 H new ATOM 0 HA ARG A 120 -20.633 10.198 -13.050 1.00 0.00 H new ATOM 0 HB2 ARG A 120 -19.588 8.418 -14.286 1.00 0.00 H new ATOM 0 HB3 ARG A 120 -18.448 8.960 -13.071 1.00 0.00 H new ATOM 0 HG2 ARG A 120 -18.833 7.033 -11.698 1.00 0.00 H new ATOM 0 HG3 ARG A 120 -20.262 6.576 -12.604 1.00 0.00 H new ATOM 0 HD2 ARG A 120 -18.694 5.121 -13.509 1.00 0.00 H new ATOM 0 HD3 ARG A 120 -18.612 6.445 -14.655 1.00 0.00 H new ATOM 0 HE ARG A 120 -16.433 6.897 -13.974 1.00 0.00 H new ATOM 0 HH11 ARG A 120 -18.061 4.853 -11.600 1.00 0.00 H new ATOM 0 HH12 ARG A 120 -16.590 4.566 -10.666 1.00 0.00 H new ATOM 0 HH21 ARG A 120 -14.546 6.523 -12.769 1.00 0.00 H new ATOM 0 HH22 ARG A 120 -14.608 5.507 -11.325 1.00 0.00 H new ATOM 1760 N GLY A 121 -22.332 8.298 -13.817 1.00 0.00 N ATOM 1761 CA GLY A 121 -23.581 7.581 -13.999 1.00 0.00 C ATOM 1762 C GLY A 121 -23.371 6.092 -14.190 1.00 0.00 C ATOM 1763 O GLY A 121 -22.799 5.422 -13.330 1.00 0.00 O ATOM 0 H GLY A 121 -21.901 8.635 -14.678 1.00 0.00 H new ATOM 0 HA2 GLY A 121 -24.221 7.746 -13.132 1.00 0.00 H new ATOM 0 HA3 GLY A 121 -24.106 7.985 -14.865 1.00 0.00 H new ATOM 1767 N THR A 122 -23.838 5.570 -15.320 1.00 0.00 N ATOM 1768 CA THR A 122 -23.701 4.150 -15.620 1.00 0.00 C ATOM 1769 C THR A 122 -22.644 3.914 -16.693 1.00 0.00 C ATOM 1770 O THR A 122 -22.152 4.857 -17.312 1.00 0.00 O ATOM 1771 CB THR A 122 -25.037 3.544 -16.090 1.00 0.00 C ATOM 1772 OG1 THR A 122 -25.503 4.231 -17.257 1.00 0.00 O ATOM 1773 CG2 THR A 122 -26.086 3.631 -14.992 1.00 0.00 C ATOM 0 H THR A 122 -24.315 6.110 -16.043 1.00 0.00 H new ATOM 0 HA THR A 122 -23.393 3.660 -14.696 1.00 0.00 H new ATOM 0 HB THR A 122 -24.870 2.494 -16.329 1.00 0.00 H new ATOM 0 HG1 THR A 122 -26.352 3.839 -17.550 1.00 0.00 H new ATOM 0 HG21 THR A 122 -27.021 3.197 -15.347 1.00 0.00 H new ATOM 0 HG22 THR A 122 -25.741 3.083 -14.115 1.00 0.00 H new ATOM 0 HG23 THR A 122 -26.249 4.675 -14.726 1.00 0.00 H new ATOM 1781 N VAL A 123 -22.299 2.648 -16.908 1.00 0.00 N ATOM 1782 CA VAL A 123 -21.301 2.288 -17.908 1.00 0.00 C ATOM 1783 C VAL A 123 -21.941 1.568 -19.089 1.00 0.00 C ATOM 1784 O VAL A 123 -22.810 0.715 -18.913 1.00 0.00 O ATOM 1785 CB VAL A 123 -20.204 1.389 -17.307 1.00 0.00 C ATOM 1786 CG1 VAL A 123 -20.780 0.041 -16.902 1.00 0.00 C ATOM 1787 CG2 VAL A 123 -19.059 1.214 -18.294 1.00 0.00 C ATOM 0 H VAL A 123 -22.696 1.855 -16.403 1.00 0.00 H new ATOM 0 HA VAL A 123 -20.850 3.218 -18.254 1.00 0.00 H new ATOM 0 HB VAL A 123 -19.812 1.873 -16.412 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -19.990 -0.580 -16.480 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -21.563 0.189 -16.158 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -21.201 -0.453 -17.778 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -18.293 0.576 -17.853 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -19.434 0.753 -19.208 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -18.629 2.188 -18.529 1.00 0.00 H new ATOM 1797 N SER A 124 -21.505 1.918 -20.295 1.00 0.00 N ATOM 1798 CA SER A 124 -22.039 1.308 -21.508 1.00 0.00 C ATOM 1799 C SER A 124 -20.962 1.207 -22.584 1.00 0.00 C ATOM 1800 O SER A 124 -20.012 1.989 -22.603 1.00 0.00 O ATOM 1801 CB SER A 124 -23.225 2.119 -22.033 1.00 0.00 C ATOM 1802 OG SER A 124 -24.268 2.176 -21.075 1.00 0.00 O ATOM 0 H SER A 124 -20.784 2.620 -20.458 1.00 0.00 H new ATOM 0 HA SER A 124 -22.377 0.302 -21.260 1.00 0.00 H new ATOM 0 HB2 SER A 124 -22.898 3.129 -22.280 1.00 0.00 H new ATOM 0 HB3 SER A 124 -23.597 1.670 -22.954 1.00 0.00 H new ATOM 0 HG SER A 124 -25.014 2.701 -21.434 1.00 0.00 H new ATOM 1808 N GLY A 125 -21.117 0.235 -23.478 1.00 0.00 N ATOM 1809 CA GLY A 125 -20.152 0.048 -24.545 1.00 0.00 C ATOM 1810 C GLY A 125 -20.744 -0.666 -25.744 1.00 0.00 C ATOM 1811 O GLY A 125 -21.931 -0.538 -26.046 1.00 0.00 O ATOM 0 H GLY A 125 -21.894 -0.426 -23.482 1.00 0.00 H new ATOM 0 HA2 GLY A 125 -19.768 1.019 -24.858 1.00 0.00 H new ATOM 0 HA3 GLY A 125 -19.304 -0.524 -24.168 1.00 0.00 H new ATOM 1815 N PRO A 126 -19.906 -1.438 -26.452 1.00 0.00 N ATOM 1816 CA PRO A 126 -20.331 -2.189 -27.637 1.00 0.00 C ATOM 1817 C PRO A 126 -21.258 -3.348 -27.286 1.00 0.00 C ATOM 1818 O PRO A 126 -21.355 -3.748 -26.126 1.00 0.00 O ATOM 1819 CB PRO A 126 -19.014 -2.714 -28.215 1.00 0.00 C ATOM 1820 CG PRO A 126 -18.086 -2.774 -27.051 1.00 0.00 C ATOM 1821 CD PRO A 126 -18.478 -1.637 -26.149 1.00 0.00 C ATOM 0 HA PRO A 126 -20.900 -1.570 -28.330 1.00 0.00 H new ATOM 0 HB2 PRO A 126 -19.145 -3.697 -28.668 1.00 0.00 H new ATOM 0 HB3 PRO A 126 -18.631 -2.053 -28.992 1.00 0.00 H new ATOM 0 HG2 PRO A 126 -18.171 -3.730 -26.533 1.00 0.00 H new ATOM 0 HG3 PRO A 126 -17.049 -2.677 -27.373 1.00 0.00 H new ATOM 0 HD2 PRO A 126 -18.321 -1.884 -25.099 1.00 0.00 H new ATOM 0 HD3 PRO A 126 -17.894 -0.740 -26.356 1.00 0.00 H new ATOM 1829 N SER A 127 -21.936 -3.883 -28.296 1.00 0.00 N ATOM 1830 CA SER A 127 -22.859 -4.994 -28.094 1.00 0.00 C ATOM 1831 C SER A 127 -22.100 -6.311 -27.958 1.00 0.00 C ATOM 1832 O SER A 127 -21.171 -6.587 -28.717 1.00 0.00 O ATOM 1833 CB SER A 127 -23.849 -5.081 -29.257 1.00 0.00 C ATOM 1834 OG SER A 127 -23.243 -5.655 -30.402 1.00 0.00 O ATOM 0 H SER A 127 -21.864 -3.565 -29.263 1.00 0.00 H new ATOM 0 HA SER A 127 -23.410 -4.814 -27.171 1.00 0.00 H new ATOM 0 HB2 SER A 127 -24.711 -5.678 -28.960 1.00 0.00 H new ATOM 0 HB3 SER A 127 -24.219 -4.085 -29.499 1.00 0.00 H new ATOM 0 HG SER A 127 -23.897 -5.701 -31.130 1.00 0.00 H new ATOM 1840 N SER A 128 -22.505 -7.122 -26.985 1.00 0.00 N ATOM 1841 CA SER A 128 -21.862 -8.409 -26.745 1.00 0.00 C ATOM 1842 C SER A 128 -22.595 -9.188 -25.657 1.00 0.00 C ATOM 1843 O SER A 128 -23.079 -8.611 -24.684 1.00 0.00 O ATOM 1844 CB SER A 128 -20.399 -8.206 -26.346 1.00 0.00 C ATOM 1845 OG SER A 128 -20.297 -7.454 -25.149 1.00 0.00 O ATOM 0 H SER A 128 -23.275 -6.911 -26.350 1.00 0.00 H new ATOM 0 HA SER A 128 -21.902 -8.985 -27.669 1.00 0.00 H new ATOM 0 HB2 SER A 128 -19.917 -9.175 -26.213 1.00 0.00 H new ATOM 0 HB3 SER A 128 -19.868 -7.693 -27.148 1.00 0.00 H new ATOM 0 HG SER A 128 -19.352 -7.339 -24.914 1.00 0.00 H new ATOM 1851 N GLY A 129 -22.672 -10.504 -25.830 1.00 0.00 N ATOM 1852 CA GLY A 129 -23.347 -11.341 -24.857 1.00 0.00 C ATOM 1853 C GLY A 129 -23.289 -12.812 -25.217 1.00 0.00 C ATOM 1854 O GLY A 129 -22.336 -13.265 -25.852 1.00 0.00 O ATOM 0 H GLY A 129 -22.279 -11.005 -26.627 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -22.893 -11.192 -23.877 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -24.389 -11.031 -24.776 1.00 0.00 H new TER 1858 GLY A 129